propan-2-yl (3S)-3-[(2,4-dimethylphenyl)carbonylamino]-3-(4-methoxyphenyl)propanoate

Systemtic Name: propan-2-yl (3S)-3-[(2,4-dimethylphenyl)carbonylamino]-3-(4-methoxyphenyl)propanoate Openeye Name: isopropyl (3S)-3-[(2,4-dimethylbenzoyl)amino]-3-(4-methoxyphenyl)propanoate CAS Name: (3S)-3-[[(2,4-dimethylphenyl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-[(2,4-dimethylbenzoyl)amino]-3-(4-methoxyphenyl)propanoate Traditional Name: (3S)-3-[(2,4-dimethylbenzoyl)amino]-3-(4-methoxyphenyl)propionic acid isopropyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(CC(=O)OC(C)C)C2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N[C@@H](CC(=O)OC(C)C)C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C22H27NO4/c1-14(2)27-21(24)13-20(17-7-9-18(26-5)10-8-17)23-22(25)19-11-6-15(3)12-16(19)4/h6-12,14,20H,13H2,1-5H3,(H,23,25)/t20-/m0/s1