N-[(E)-4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-enyl]-4-pyridin-2-yl-benzamide

Systemtic Name: N-[(E)-4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-enyl]-4-pyridin-2-yl-benzamide Openeye Name: N-[(E)-4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-enyl]-4-(2-pyridyl)benzamide CAS Name: N-[(E)-4-[4-(2-methoxyphenyl)-1-piperazinyl]but-2-enyl]-4-(2-pyridinyl)benzamide IUPAC Name: N-[(E)-4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-enyl]-4-pyridin-2-ylbenzamide Traditional Name: N-[(E)-4-[4-(2-methoxyphenyl)piperazino]but-2-enyl]-4-(2-pyridyl)benzamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC=CCNC(=O)C3=CC=C(C=C3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C/C=C/CNC(=O)C3=CC=C(C=C3)C4=CC=CC=N4

InChI

InChI=1S/C27H30N4O2/c1-33-26-10-3-2-9-25(26)31-20-18-30(19-21-31)17-7-6-16-29-27(32)23-13-11-22(12-14-23)24-8-4-5-15-28-24/h2-15H,16-21H2,1H3,(H,29,32)/b7-6+