(3S)-1-[(4-ethanoyl-1H-pyrrol-2-yl)carbonyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[(4-ethanoyl-1H-pyrrol-2-yl)carbonyl]piperidine-3-carboxylate Openeye Name: (3S)-1-(4-acetyl-1H-pyrrole-2-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(4-acetyl-1H-pyrrole-2-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(4-acetyl-1H-pyrrole-2-carbonyl)nipecotate Formula: C13H15N2O4- MolecularWeight: 263.2692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C13H16N2O4/c1-8(16)10-5-11(14-6-10)12(17)15-4-2-3-9(7-15)13(18)19/h5-6,9,14H,2-4,7H2,1H3,(H,18,19)/p-1/t9-/m0/s1