methyl 3-[(4-cyanophenyl)carbonylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[(4-cyanophenyl)carbonylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-[(4-cyanobenzoyl)amino]-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[[(4-cyanophenyl)-oxomethyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(4-cyanobenzoyl)amino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-[(4-cyanobenzoyl)amino]-4-pyrrolidino-benzoic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19N3O3/c1-26-20(25)16-8-9-18(23-10-2-3-11-23)17(12-16)22-19(24)15-6-4-14(13-21)5-7-15/h4-9,12H,2-3,10-11H2,1H3,(H,22,24)