2-[[(E)-4-oxidanylidene-4-piperidin-1-yl-but-2-en-2-yl]amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[[(E)-4-oxidanylidene-4-piperidin-1-yl-but-2-en-2-yl]amino]-2-phenyl-ethanoic acid Openeye Name: 2-[[(E)-1-methyl-3-oxo-3-(1-piperidyl)prop-1-enyl]amino]-2-phenyl-acetic acid CAS Name: 2-[[(E)-4-oxo-4-(1-piperidinyl)but-2-en-2-yl]amino]-2-phenylacetic acid IUPAC Name: 2-[[(E)-4-oxo-4-piperidin-1-ylbut-2-en-2-yl]amino]-2-phenylacetic acid Traditional Name: 2-[[(E)-3-keto-1-methyl-3-piperidino-prop-1-enyl]amino]-2-phenyl-acetic acid Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCCCC1)NC(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C/C(=C\C(=O)N1CCCCC1)/NC(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H22N2O3/c1-13(12-15(20)19-10-6-3-7-11-19)18-16(17(21)22)14-8-4-2-5-9-14/h2,4-5,8-9,12,16,18H,3,6-7,10-11H2,1H3,(H,21,22)/b13-12+