ethyl 3-[(2-nitrophenyl)methyl]-2-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(2-nitrophenyl)methyl]-2-oxidanylidene-piperidine-3-carboxylate Openeye Name: ethyl 3-[(2-nitrophenyl)methyl]-2-oxo-piperidine-3-carboxylate CAS Name: 3-[(2-nitrophenyl)methyl]-2-oxo-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-nitrophenyl)methyl]-2-oxopiperidine-3-carboxylate Traditional Name: 2-keto-3-(2-nitrobenzyl)nipecotic acid ethyl ester Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCNC1=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1(CCCNC1=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O5/c1-2-22-14(19)15(8-5-9-16-13(15)18)10-11-6-3-4-7-12(11)17(20)21/h3-4,6-7H,2,5,8-10H2,1H3,(H,16,18)