4-[[1-(4-cyanophenyl)-2-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]butanoic acid

Systemtic Name: 4-[[1-(4-cyanophenyl)-2-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]butanoic acid Openeye Name: 4-[[1-(4-cyanophenyl)-2-oxo-pyrrolidin-3-yl]carbamoylamino]butanoic acid CAS Name: 4-[[[[1-(4-cyanophenyl)-2-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[1-(4-cyanophenyl)-2-oxopyrrolidin-3-yl]carbamoylamino]butanoic acid Traditional Name: 4-[[1-(4-cyanophenyl)-2-keto-pyrrolidin-3-yl]carbamoylamino]butyric acid Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NC(=O)NCCCC(=O)O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CN(C(=O)C1NC(=O)NCCCC(=O)O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H18N4O4/c17-10-11-3-5-12(6-4-11)20-9-7-13(15(20)23)19-16(24)18-8-1-2-14(21)22/h3-6,13H,1-2,7-9H2,(H,21,22)(H2,18,19,24)