ethyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]piperidine-3-carboxylate CAS Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]piperidine-3-carboxylate Traditional Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]nipecotic acid ethyl ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H21NO5/c1-2-22-18(21)14-4-3-9-19(11-14)17(20)8-6-13-5-7-15-16(10-13)24-12-23-15/h5-8,10,14H,2-4,9,11-12H2,1H3/b8-6+