methyl 1-[(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-enoyl]piperidine-2-carboxylate

Systemtic Name: methyl 1-[(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-enoyl]piperidine-2-carboxylate Openeye Name: methyl 1-[(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-enoyl]piperidine-2-carboxylate CAS Name: 1-[(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]-1-oxoprop-2-enyl]-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]prop-2-enoyl]piperidine-2-carboxylate Traditional Name: 1-[(E)-3-[3-ethoxy-4-(2-phenoxyethoxy)phenyl]acryloyl]pipecolinic acid methyl ester Formula: C26H31NO6 MolecularWeight: 453.52744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)N2CCCCC2C(=O)OC)OCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)N2CCCCC2C(=O)OC)OCCOC3=CC=CC=C3

InChI

InChI=1S/C26H31NO6/c1-3-31-24-19-20(12-14-23(24)33-18-17-32-21-9-5-4-6-10-21)13-15-25(28)27-16-8-7-11-22(27)26(29)30-2/h4-6,9-10,12-15,19,22H,3,7-8,11,16-18H2,1-2H3/b15-13+