(3S)-1-[(E)-3-(furan-2-yl)prop-2-enoyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[(E)-3-(furan-2-yl)prop-2-enoyl]piperidine-3-carboxylate Openeye Name: (3S)-1-[(E)-3-(2-furyl)prop-2-enoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-[(E)-3-(furan-2-yl)prop-2-enoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[(E)-3-(2-furyl)acryloyl]nipecotate Formula: C13H14NO4- MolecularWeight: 248.25456

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC=CO2)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)/C=C/C2=CC=CO2)C(=O)[O-]

InChI

InChI=1S/C13H15NO4/c15-12(6-5-11-4-2-8-18-11)14-7-1-3-10(9-14)13(16)17/h2,4-6,8,10H,1,3,7,9H2,(H,16,17)/p-1/b6-5+/t10-/m0/s1