2-[(4-cyanophenyl)carbonyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(4-cyanophenyl)carbonyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[(4-cyanobenzoyl)-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[[(4-cyanophenyl)-oxomethyl]-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[(4-cyanobenzoyl)-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[(4-cyanobenzoyl)-(cyclopropylmethyl)amino]acetic acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CC1CN(CC(=O)O)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H14N2O3/c15-7-10-3-5-12(6-4-10)14(19)16(9-13(17)18)8-11-1-2-11/h3-6,11H,1-2,8-9H2,(H,17,18)