methyl 4-[[1-[(3-ethanoylphenyl)carbamoyl]pyrrolidin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-[(3-ethanoylphenyl)carbamoyl]pyrrolidin-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-[(3-acetylphenyl)carbamoyl]pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(3-acetylanilino)-oxomethyl]-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[(3-acetylphenyl)carbamoyl]pyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[1-[(3-acetylphenyl)carbamoyl]prolyl]amino]benzoic acid methyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H23N3O5/c1-14(26)16-5-3-6-18(13-16)24-22(29)25-12-4-7-19(25)20(27)23-17-10-8-15(9-11-17)21(28)30-2/h3,5-6,8-11,13,19H,4,7,12H2,1-2H3,(H,23,27)(H,24,29)