1-azanyl-8-(hexadecylamino)-4,5-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1-azanyl-8-(hexadecylamino)-4,5-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1-amino-8-(hexadecylamino)-4,5-dihydroxy-anthracene-9,10-dione CAS Name: 1-amino-8-(hexadecylamino)-4,5-dihydroxyanthracene-9,10-dione IUPAC Name: 1-amino-8-(hexadecylamino)-4,5-dihydroxyanthracene-9,10-dione Traditional Name: 1-amino-8-(cetylamino)-4,5-dihydroxy-9,10-anthraquinone Formula: C30H42N2O4 MolecularWeight: 494.66548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)N)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)N)O

InChI

InChI=1S/C30H42N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-32-22-17-19-24(34)28-26(22)29(35)25-21(31)16-18-23(33)27(25)30(28)36/h16-19,32-34H,2-15,20,31H2,1H3