(2S,3R)-2-(furan-2-yl)-1-(3-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: (2S,3R)-2-(furan-2-yl)-1-(3-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: (2S,3R)-2-(2-furyl)-1-(m-tolyl)-6-oxo-piperidine-3-carboxylate CAS Name: (2S,3R)-2-(2-furanyl)-1-(3-methylphenyl)-6-oxo-3-piperidinecarboxylate IUPAC Name: (2S,3R)-2-(furan-2-yl)-1-(3-methylphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: (2S,3R)-2-(2-furyl)-6-keto-1-(m-tolyl)nipecotate Formula: C17H16NO4- MolecularWeight: 298.31324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(C(CCC2=O)C(=O)[O-])C3=CC=CO3

Isomeric SMILES

CC1=CC(=CC=C1)N2[C@@H]([C@@H](CCC2=O)C(=O)[O-])C3=CC=CO3

InChI

InChI=1S/C17H17NO4/c1-11-4-2-5-12(10-11)18-15(19)8-7-13(17(20)21)16(18)14-6-3-9-22-14/h2-6,9-10,13,16H,7-8H2,1H3,(H,20,21)/p-1/t13-,16+/m1/s1