methyl 2-[[(3S)-5-oxidanylidene-1-(4-propoxyphenyl)pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(3S)-5-oxidanylidene-1-(4-propoxyphenyl)pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(3S)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[(3S)-5-oxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3S)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 2-[[(3S)-5-keto-1-(4-propoxyphenyl)pyrrolidine-3-carbonyl]amino]benzoic acid methyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H24N2O5/c1-3-12-29-17-10-8-16(9-11-17)24-14-15(13-20(24)25)21(26)23-19-7-5-4-6-18(19)22(27)28-2/h4-11,15H,3,12-14H2,1-2H3,(H,23,26)/t15-/m0/s1