methyl 2-(cyclohexen-1-ylmethyl)-3-[[4-(3-ethylphenyl)phenyl]carbonylamino]pentanoate

Systemtic Name: methyl 2-(cyclohexen-1-ylmethyl)-3-[[4-(3-ethylphenyl)phenyl]carbonylamino]pentanoate Openeye Name: methyl 2-(cyclohexen-1-ylmethyl)-3-[[4-(3-ethylphenyl)benzoyl]amino]pentanoate CAS Name: 2-(1-cyclohexenylmethyl)-3-[[[4-(3-ethylphenyl)phenyl]-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-(cyclohexen-1-ylmethyl)-3-[[4-(3-ethylphenyl)benzoyl]amino]pentanoate Traditional Name: 2-(cyclohexen-1-ylmethyl)-3-[[4-(3-ethylphenyl)benzoyl]amino]valeric acid methyl ester Formula: C28H35NO3 MolecularWeight: 433.5824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NC(CC)C(CC3=CCCCC3)C(=O)OC

Isomeric SMILES

CCC1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NC(CC)C(CC3=CCCCC3)C(=O)OC

InChI

InChI=1S/C28H35NO3/c1-4-20-12-9-13-24(18-20)22-14-16-23(17-15-22)27(30)29-26(5-2)25(28(31)32-3)19-21-10-7-6-8-11-21/h9-10,12-18,25-26H,4-8,11,19H2,1-3H3,(H,29,30)