1-[4-[[15,17,17-tris(aziridin-1-yl)-2,5,8,11,14-pentaoxa-16,18,19-triaza-1$l^{5},15$l^{5},17$l^{5}-triphosphabicyclo[13.3.1]nonadeca-1(19),15,17-trien-1-yl]amino]butylamino]anthracene-9,10-dione

Systemtic Name: 1-[4-[[15,17,17-tris(aziridin-1-yl)-2,5,8,11,14-pentaoxa-16,18,19-triaza-1$l^{5},15$l^{5},17$l^{5}-triphosphabicyclo[13.3.1]nonadeca-1(19),15,17-trien-1-yl]amino]butylamino]anthracene-9,10-dione Openeye Name: 1-[4-[[15,17,17-tris(aziridin-1-yl)-2,5,8,11,14-pentaoxa-16,18,19-triaza-1$l^{5},15$l^{5},17$l^{5}-triphosphabicyclo[13.3.1]nonadeca-1(19),15,17-trien-1-yl]amino]butylamino]anthracene-9,10-dione CAS Name: 1-[4-[[15,17,17-tris(1-aziridinyl)-2,5,8,11,14-pentaoxa-16,18,19-triaza-1$l^{5},15$l^{5},17$l^{5}-triphosphabicyclo[13.3.1]nonadeca-1(19),15,17-trien-1-yl]amino]butylamino]anthracene-9,10-dione IUPAC Name: 1-[4-[[15,17,17-tris(aziridin-1-yl)-2,5,8,11,14-pentaoxa-16,18,19-triaza-1$l^{5},15$l^{5},17$l^{5}-triphosphabicyclo[13.3.1]nonadeca-1(19),15,17-trien-1-yl]amino]butylamino]anthracene-9,10-dione Traditional Name: 1-[4-[(15,17,17-triethylenimino-2,5,8,11,14-pentaoxa-16,18,19-triaza-1$l^{5},15$l^{5},17$l^{5}-triphosphabicyclo[13.3.1]nonadeca-1(19),15,17-trien-1-yl)amino]butylamino]-9,10-anthraquinone Formula: C32H45N8O7P3 MolecularWeight: 746.670383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1P2(=NP3(=NP(=N2)(OCCOCCOCCOCCO3)N4CC4)NCCCCNC5=CC=CC6=C5C(=O)C7=CC=CC=C7C6=O)N8CC8

Isomeric SMILES

C1CN1P2(=NP3(=NP(=N2)(OCCOCCOCCOCCO3)N4CC4)NCCCCNC5=CC=CC6=C5C(=O)C7=CC=CC=C7C6=O)N8CC8

InChI

InChI=1S/C32H45N8O7P3/c41-31-26-6-1-2-7-27(26)32(42)30-28(31)8-5-9-29(30)33-10-3-4-11-34-48-35-49(38-12-13-38,39-14-15-39)37-50(36-48,40-16-17-40)47-25-23-45-21-19-43-18-20-44-22-24-46-48/h1-2,5-9,33-34H,3-4,10-25H2