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

Systemtic Name: N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-4-propan-2-yl-benzamide Openeye Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-4-isopropyl-benzamide CAS Name: N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-propan-2-ylbenzamide IUPAC Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-4-propan-2-ylbenzamide Traditional Name: N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]-4-isopropyl-benzamide Formula: C28H30ClN3O2 MolecularWeight: 476.0097

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C28H30ClN3O2/c1-19(2)21-11-13-22(14-12-21)27(33)30-25-6-4-5-24(29)26(25)31-15-17-32(18-16-31)28(34)23-9-7-20(3)8-10-23/h4-14,19H,15-18H2,1-3H3,(H,30,33)