N-[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3,4,5-triethoxy-benzamide CAS Name: N-[3-chloro-4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3,4,5-triethoxybenzamide Traditional Name: N-[3-chloro-4-(4-isobutyrylpiperazino)phenyl]-3,4,5-triethoxy-benzamide Formula: C27H36ClN3O5 MolecularWeight: 518.04484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C(C)C)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C(C)C)Cl

InChI

InChI=1S/C27H36ClN3O5/c1-6-34-23-15-19(16-24(35-7-2)25(23)36-8-3)26(32)29-20-9-10-22(21(28)17-20)30-11-13-31(14-12-30)27(33)18(4)5/h9-10,15-18H,6-8,11-14H2,1-5H3,(H,29,32)