3-butan-2-yloxy-N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 3-butan-2-yloxy-N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-butan-2-yloxy-N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-3-sec-butoxy-benzamide Formula: C29H32ClN3O3 MolecularWeight: 506.03568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C)Cl

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C)Cl

InChI

InChI=1S/C29H32ClN3O3/c1-4-21(3)36-24-10-7-9-22(18-24)28(34)31-23-12-13-27(26(30)19-23)32-14-16-33(17-15-32)29(35)25-11-6-5-8-20(25)2/h5-13,18-19,21H,4,14-17H2,1-3H3,(H,31,34)