N-butyl-4-[15-[4-(butylamino)phenyl]-21,22-dihydroporphyrin-5-yl]aniline

Systemtic Name: N-butyl-4-[15-[4-(butylamino)phenyl]-21,22-dihydroporphyrin-5-yl]aniline Openeye Name: N-butyl-4-[15-[4-(butylamino)phenyl]-21,22-dihydroporphyrin-5-yl]aniline CAS Name: N-butyl-4-[15-[4-(butylamino)phenyl]-21,22-dihydroporphyrin-5-yl]aniline IUPAC Name: N-butyl-4-[15-[4-(butylamino)phenyl]-21,22-dihydroporphyrin-5-yl]aniline Traditional Name: butyl-[4-[15-[4-(butylamino)phenyl]-21,22-dihydroporphin-5-yl]phenyl]amine Formula: C40H40N6 MolecularWeight: 604.7858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=NC(=CC6=CC=C2N6)C=C5)C7=CC=C(C=C7)NCCCC)C=C4)N3

Isomeric SMILES

CCCCNC1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=NC(=CC6=CC=C2N6)C=C5)C7=CC=C(C=C7)NCCCC)C=C4)N3

InChI

InChI=1S/C40H40N6/c1-3-5-23-41-29-11-7-27(8-12-29)39-35-19-15-31(43-35)25-33-17-21-37(45-33)40(28-9-13-30(14-10-28)42-24-6-4-2)38-22-18-34(46-38)26-32-16-20-36(39)44-32/h7-22,25-26,41-44H,3-6,23-24H2,1-2H3