1-(4-phenylbutan-2-ylamino)-4-(propan-2-ylamino)anthracene-9,10-dione

Systemtic Name: 1-(4-phenylbutan-2-ylamino)-4-(propan-2-ylamino)anthracene-9,10-dione Openeye Name: 1-(isopropylamino)-4-[(1-methyl-3-phenyl-propyl)amino]anthracene-9,10-dione CAS Name: 1-(4-phenylbutan-2-ylamino)-4-(propan-2-ylamino)anthracene-9,10-dione IUPAC Name: 1-(4-phenylbutan-2-ylamino)-4-(propan-2-ylamino)anthracene-9,10-dione Traditional Name: 1-(isopropylamino)-4-[(1-methyl-3-phenyl-propyl)amino]-9,10-anthraquinone Formula: C27H28N2O2 MolecularWeight: 412.52342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C2C(=C(C=C1)NC(C)CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

CC(C)NC1=C2C(=C(C=C1)NC(C)CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C27H28N2O2/c1-17(2)28-22-15-16-23(29-18(3)13-14-19-9-5-4-6-10-19)25-24(22)26(30)20-11-7-8-12-21(20)27(25)31/h4-12,15-18,28-29H,13-14H2,1-3H3