N-(phenylmethyl)-1-[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-benzyl-1-[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-(2,4,5-trimethoxyphenyl)prop-2-enyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-asarylacryloyl]-N-benzyl-isonipecotamide Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C25H30N2O5/c1-30-21-16-23(32-3)22(31-2)15-20(21)9-10-24(28)27-13-11-19(12-14-27)25(29)26-17-18-7-5-4-6-8-18/h4-10,15-16,19H,11-14,17H2,1-3H3,(H,26,29)/b10-9+