N-[3-chloranyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-3,5-diethoxy-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-3,5-diethoxy-benzamide Openeye Name: N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-3,5-diethoxy-benzamide CAS Name: N-[3-chloro-4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-3,5-diethoxybenzamide IUPAC Name: N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-3,5-diethoxybenzamide Traditional Name: N-[3-chloro-4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-3,5-diethoxy-benzamide Formula: C30H32ClN3O4 MolecularWeight: 534.04578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4)Cl)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)Cl)OCC

InChI

InChI=1S/C30H32ClN3O4/c1-3-37-25-18-23(19-26(21-25)38-4-2)30(36)32-24-11-12-28(27(31)20-24)33-14-16-34(17-15-33)29(35)13-10-22-8-6-5-7-9-22/h5-13,18-21H,3-4,14-17H2,1-2H3,(H,32,36)/b13-10+