N-[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)prop-2-enoyl]piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)prop-2-enoyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)prop-2-enoyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[(E)-3-(4-butoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[(E)-3-(4-butoxy-3-methoxyphenyl)prop-2-enoyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)acryloyl]-4-piperidyl]-4-fluoro-benzamide Formula: C26H31FN2O4 MolecularWeight: 454.533743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C26H31FN2O4/c1-3-4-17-33-23-11-5-19(18-24(23)32-2)6-12-25(30)29-15-13-22(14-16-29)28-26(31)20-7-9-21(27)10-8-20/h5-12,18,22H,3-4,13-17H2,1-2H3,(H,28,31)/b12-6+