(E)-4-oxidanylidene-4-[[1-(phenylmethyl)piperidin-4-yl]amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[[1-(phenylmethyl)piperidin-4-yl]amino]but-2-enoic acid Openeye Name: (E)-4-[(1-benzyl-4-piperidyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[[1-(phenylmethyl)-4-piperidinyl]amino]-2-butenoic acid IUPAC Name: (E)-4-[(1-benzylpiperidin-4-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(1-benzyl-4-piperidyl)amino]-4-keto-but-2-enoic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C=CC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1NC(=O)/C=C/C(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O3/c19-15(6-7-16(20)21)17-14-8-10-18(11-9-14)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H,17,19)(H,20,21)/b7-6+