methyl (3S)-3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[1-(4-methoxyphenyl)-2,5-dimethylpyrrole-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: (3S)-3-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)N[C@@H](CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4/c1-16-14-21(17(2)26(16)19-10-12-20(29-3)13-11-19)24(28)25-22(15-23(27)30-4)18-8-6-5-7-9-18/h5-14,22H,15H2,1-4H3,(H,25,28)/t22-/m0/s1