(2E)-2-[azanyl(oxidanyl)methylidene]-4,7-bis(dimethylamino)-10,11,12a-tris(oxidanyl)-9-[[(phenylmethyl)amino]methyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione

Systemtic Name: (2E)-2-[azanyl(oxidanyl)methylidene]-4,7-bis(dimethylamino)-10,11,12a-tris(oxidanyl)-9-[[(phenylmethyl)amino]methyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Openeye Name: (2E)-2-[amino(hydroxy)methylene]-9-[(benzylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione CAS Name: (2E)-2-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-9-[[(phenylmethyl)amino]methyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione IUPAC Name: (2E)-2-[amino(hydroxy)methylidene]-9-[(benzylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Traditional Name: (2E)-2-[amino(hydroxy)methylene]-9-[(benzylamino)methyl]-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Formula: C31H36N4O7 MolecularWeight: 576.64014

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C2CC3CC4=C(C=C(C(=C4C(=C3C(=O)C2(C(=O)C(=C(N)O)C1=O)O)O)O)CNCC5=CC=CC=C5)N(C)C

Isomeric SMILES

CN(C)C1C2CC3CC4=C(C=C(C(=C4C(=C3C(=O)C2(C(=O)/C(=C(\N)/O)/C1=O)O)O)O)CNCC5=CC=CC=C5)N(C)C

InChI

InChI=1S/C31H36N4O7/c1-34(2)20-12-17(14-33-13-15-8-6-5-7-9-15)25(36)22-18(20)10-16-11-19-24(35(3)4)27(38)23(30(32)41)29(40)31(19,42)28(39)21(16)26(22)37/h5-9,12,16,19,24,33,36-37,41-42H,10-11,13-14,32H2,1-4H3/b30-23+