methyl 3-[4-aminocarbonyl-5-methyl-3-(3-phenoxyphenyl)-1-(phenylmethyl)pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-5-methyl-3-(3-phenoxyphenyl)-1-(phenylmethyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[1-benzyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)-1-(phenylmethyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-benzyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propanoate Traditional Name: 3-[1-benzyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propionic acid methyl ester Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2)CCC(=O)OC)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2)CCC(=O)OC)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C29H28N2O4/c1-20-27(29(30)33)28(22-12-9-15-24(18-22)35-23-13-7-4-8-14-23)25(16-17-26(32)34-2)31(20)19-21-10-5-3-6-11-21/h3-15,18H,16-17,19H2,1-2H3,(H2,30,33)