ethyl 1-[2-[1,3-benzodioxol-5-yl-[(2-prop-2-enoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[1,3-benzodioxol-5-yl-[(2-prop-2-enoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[(2-allyloxyphenyl)methyl-(1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-[1,3-benzodioxol-5-yl-[(2-prop-2-enoxyphenyl)methyl]amino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[1,3-benzodioxol-5-yl-[(2-prop-2-enoxyphenyl)methyl]amino]-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-[(2-allyloxybenzyl)-(1,3-benzodioxol-5-yl)amino]-2-keto-ethyl]nipecotic acid ethyl ester Formula: C27H32N2O6 MolecularWeight: 480.55278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)N(CC2=CC=CC=C2OCC=C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)N(CC2=CC=CC=C2OCC=C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H32N2O6/c1-3-14-33-23-10-6-5-8-20(23)17-29(22-11-12-24-25(15-22)35-19-34-24)26(30)18-28-13-7-9-21(16-28)27(31)32-4-2/h3,5-6,8,10-12,15,21H,1,4,7,9,13-14,16-19H2,2H3