1-azanyl-4-(4-butylphenyl)-2-(2-phenylpropoxy)anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(4-butylphenyl)-2-(2-phenylpropoxy)anthracene-9,10-dione Openeye Name: 1-amino-4-(4-butylphenyl)-2-(2-phenylpropoxy)anthracene-9,10-dione CAS Name: 1-amino-4-(4-butylphenyl)-2-(2-phenylpropoxy)anthracene-9,10-dione IUPAC Name: 1-amino-4-(4-butylphenyl)-2-(2-phenylpropoxy)anthracene-9,10-dione Traditional Name: 1-amino-4-(4-butylphenyl)-2-(2-phenylpropoxy)-9,10-anthraquinone Formula: C33H31NO3 MolecularWeight: 489.60414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OCC(C)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OCC(C)C5=CC=CC=C5

InChI

InChI=1S/C33H31NO3/c1-3-4-10-22-15-17-24(18-16-22)27-19-28(37-20-21(2)23-11-6-5-7-12-23)31(34)30-29(27)32(35)25-13-8-9-14-26(25)33(30)36/h5-9,11-19,21H,3-4,10,20,34H2,1-2H3