4-[[[(E)-3-(2-chlorophenyl)prop-2-enoyl]-(4-piperidin-1-ylphenyl)amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 4-[[[(E)-3-(2-chlorophenyl)prop-2-enoyl]-(4-piperidin-1-ylphenyl)amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: 4-[[N-[(E)-3-(2-chlorophenyl)prop-2-enoyl]-4-(1-piperidyl)anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide CAS Name: 4-[[N-[(E)-3-(2-chlorophenyl)-1-oxoprop-2-enyl]-4-(1-piperidinyl)anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide IUPAC Name: 4-[(N-[(E)-3-(2-chlorophenyl)prop-2-enoyl]-4-piperidin-1-ylanilino)methyl]-N-(2H-tetrazol-5-yl)benzamide Traditional Name: 4-[(N-[(E)-3-(2-chlorophenyl)acryloyl]-4-piperidino-anilino)methyl]-N-(2H-tetrazol-5-yl)benzamide Formula: C29H28ClN7O2 MolecularWeight: 542.03132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)C(=O)NC4=NNN=N4)C(=O)C=CC5=CC=CC=C5Cl

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)C(=O)NC4=NNN=N4)C(=O)/C=C/C5=CC=CC=C5Cl

InChI

InChI=1S/C29H28ClN7O2/c30-26-7-3-2-6-22(26)12-17-27(38)37(25-15-13-24(14-16-25)36-18-4-1-5-19-36)20-21-8-10-23(11-9-21)28(39)31-29-32-34-35-33-29/h2-3,6-17H,1,4-5,18-20H2,(H2,31,32,33,34,35,39)/b17-12+