ethyl 4-[4-(4-aminophenyl)-2-methyl-phenyl]-4-oxidanylidene-2-phenethyl-butanoate

Systemtic Name: ethyl 4-[4-(4-aminophenyl)-2-methyl-phenyl]-4-oxidanylidene-2-phenethyl-butanoate Openeye Name: ethyl 4-[4-(4-aminophenyl)-2-methyl-phenyl]-4-oxo-2-phenethyl-butanoate CAS Name: 4-[4-(4-aminophenyl)-2-methylphenyl]-4-oxo-2-phenethylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-aminophenyl)-2-methylphenyl]-4-oxo-2-phenethylbutanoate Traditional Name: 4-[4-(4-aminophenyl)-2-methyl-phenyl]-4-keto-2-phenethyl-butyric acid ethyl ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)CC(=O)C2=C(C=C(C=C2)C3=CC=C(C=C3)N)C

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)CC(=O)C2=C(C=C(C=C2)C3=CC=C(C=C3)N)C

InChI

InChI=1S/C27H29NO3/c1-3-31-27(30)23(10-9-20-7-5-4-6-8-20)18-26(29)25-16-13-22(17-19(25)2)21-11-14-24(28)15-12-21/h4-8,11-17,23H,3,9-10,18,28H2,1-2H3