N-(5-chloranyl-2-methoxy-phenyl)-3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[4-(m-tolylmethyl)piperazin-1-yl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[4-[(3-methylphenyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[4-(3-methylbenzyl)piperazino]propionamide Formula: C22H28ClN3O2 MolecularWeight: 401.92962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C22H28ClN3O2/c1-17-4-3-5-18(14-17)16-26-12-10-25(11-13-26)9-8-22(27)24-20-15-19(23)6-7-21(20)28-2/h3-7,14-15H,8-13,16H2,1-2H3,(H,24,27)