1-[[4-(2-hydroxyethyl)phenyl]amino]-4-(pentan-3-ylamino)anthracene-9,10-dione

Systemtic Name: 1-[[4-(2-hydroxyethyl)phenyl]amino]-4-(pentan-3-ylamino)anthracene-9,10-dione Openeye Name: 1-(1-ethylpropylamino)-4-[4-(2-hydroxyethyl)anilino]anthracene-9,10-dione CAS Name: 1-[4-(2-hydroxyethyl)anilino]-4-(pentan-3-ylamino)anthracene-9,10-dione IUPAC Name: 1-[4-(2-hydroxyethyl)anilino]-4-(pentan-3-ylamino)anthracene-9,10-dione Traditional Name: 1-(1-ethylpropylamino)-4-[4-(2-hydroxyethyl)anilino]-9,10-anthraquinone Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C2C(=C(C=C1)NC3=CC=C(C=C3)CCO)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

CCC(CC)NC1=C2C(=C(C=C1)NC3=CC=C(C=C3)CCO)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C27H28N2O3/c1-3-18(4-2)28-22-13-14-23(29-19-11-9-17(10-12-19)15-16-30)25-24(22)26(31)20-7-5-6-8-21(20)27(25)32/h5-14,18,28-30H,3-4,15-16H2,1-2H3