N-[3-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[3-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]-3,4-dimethyl-benzamide Openeye Name: N-[3-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]-3,4-dimethyl-benzamide CAS Name: N-[3-chloro-2-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-3,4-dimethylbenzamide IUPAC Name: N-[3-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]-3,4-dimethylbenzamide Traditional Name: N-[3-chloro-2-(4-propionylpiperazino)phenyl]-3,4-dimethyl-benzamide Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H26ClN3O2/c1-4-20(27)25-10-12-26(13-11-25)21-18(23)6-5-7-19(21)24-22(28)17-9-8-15(2)16(3)14-17/h5-9,14H,4,10-13H2,1-3H3,(H,24,28)