1,1-bis(azanyl)-4-cyclohexyl-4-[(phenylmethyl)amino]anthracene-9,10-dione

Systemtic Name: 1,1-bis(azanyl)-4-cyclohexyl-4-[(phenylmethyl)amino]anthracene-9,10-dione Openeye Name: 1,1-diamino-4-(benzylamino)-4-cyclohexyl-anthracene-9,10-dione CAS Name: 1,1-diamino-4-cyclohexyl-4-[(phenylmethyl)amino]anthracene-9,10-dione IUPAC Name: 1,1-diamino-4-(benzylamino)-4-cyclohexylanthracene-9,10-dione Traditional Name: 1,1-diamino-4-(benzylamino)-4-cyclohexyl-9,10-anthraquinone Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2(C=CC(C3=C2C(=O)C4=CC=CC=C4C3=O)(N)N)NCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C2(C=CC(C3=C2C(=O)C4=CC=CC=C4C3=O)(N)N)NCC5=CC=CC=C5

InChI

InChI=1S/C27H29N3O2/c28-27(29)16-15-26(19-11-5-2-6-12-19,30-17-18-9-3-1-4-10-18)22-23(27)25(32)21-14-8-7-13-20(21)24(22)31/h1,3-4,7-10,13-16,19,30H,2,5-6,11-12,17,28-29H2