(4E)-4-(2-methoxy-2-oxidanylidene-ethylidene)-3-(phenylmethyl)piperidine-1,3-dicarboxylic acid

Systemtic Name: (4E)-4-(2-methoxy-2-oxidanylidene-ethylidene)-3-(phenylmethyl)piperidine-1,3-dicarboxylic acid Openeye Name: (4E)-3-benzyl-4-(2-methoxy-2-oxo-ethylidene)piperidine-1,3-dicarboxylic acid CAS Name: (4E)-4-(2-methoxy-2-oxoethylidene)-3-(phenylmethyl)piperidine-1,3-dicarboxylic acid IUPAC Name: (4E)-3-benzyl-4-(2-methoxy-2-oxoethylidene)piperidine-1,3-dicarboxylic acid Traditional Name: (4E)-3-benzyl-4-(2-keto-2-methoxy-ethylidene)piperidine-1,3-dicarboxylic acid Formula: C17H19NO6 MolecularWeight: 333.33586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C1CCN(CC1(CC2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

COC(=O)/C=C/1\CCN(CC1(CC2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C17H19NO6/c1-24-14(19)9-13-7-8-18(16(22)23)11-17(13,15(20)21)10-12-5-3-2-4-6-12/h2-6,9H,7-8,10-11H2,1H3,(H,20,21)(H,22,23)/b13-9+