methyl 3-[1-[(2-tert-butylphenyl)amino]-1-oxidanylidene-octan-3-yl]-4-(2,4-dimethoxyphenyl)benzoate

Systemtic Name: methyl 3-[1-[(2-tert-butylphenyl)amino]-1-oxidanylidene-octan-3-yl]-4-(2,4-dimethoxyphenyl)benzoate Openeye Name: methyl 3-[1-[2-(2-tert-butylanilino)-2-oxo-ethyl]hexyl]-4-(2,4-dimethoxyphenyl)benzoate CAS Name: 3-[1-(2-tert-butylanilino)-1-oxooctan-3-yl]-4-(2,4-dimethoxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 3-[1-(2-tert-butylanilino)-1-oxooctan-3-yl]-4-(2,4-dimethoxyphenyl)benzoate Traditional Name: 3-[1-[2-(2-tert-butylanilino)-2-keto-ethyl]hexyl]-4-(2,4-dimethoxyphenyl)benzoic acid methyl ester Formula: C34H43NO5 MolecularWeight: 545.70892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=CC=CC=C1C(C)(C)C)C2=C(C=CC(=C2)C(=O)OC)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=CC=CC=C1C(C)(C)C)C2=C(C=CC(=C2)C(=O)OC)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C34H43NO5/c1-8-9-10-13-23(21-32(36)35-30-15-12-11-14-29(30)34(2,3)4)28-20-24(33(37)40-7)16-18-26(28)27-19-17-25(38-5)22-31(27)39-6/h11-12,14-20,22-23H,8-10,13,21H2,1-7H3,(H,35,36)