3-[3-methyl-4-(phenylmethyl)piperazin-1-yl]propyl N-(4-chlorophenyl)carbamate

Systemtic Name: 3-[3-methyl-4-(phenylmethyl)piperazin-1-yl]propyl N-(4-chlorophenyl)carbamate Openeye Name: 3-(4-benzyl-3-methyl-piperazin-1-yl)propyl N-(4-chlorophenyl)carbamate CAS Name: N-(4-chlorophenyl)carbamic acid 3-[3-methyl-4-(phenylmethyl)-1-piperazinyl]propyl ester IUPAC Name: 3-(4-benzyl-3-methylpiperazin-1-yl)propyl N-(4-chlorophenyl)carbamate Traditional Name: N-(4-chlorophenyl)carbamic acid 3-(4-benzyl-3-methyl-piperazino)propyl ester Formula: C22H28ClN3O2 MolecularWeight: 401.92962

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2=CC=CC=C2)CCCOC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CN(CCN1CC2=CC=CC=C2)CCCOC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O2/c1-18-16-25(13-14-26(18)17-19-6-3-2-4-7-19)12-5-15-28-22(27)24-21-10-8-20(23)9-11-21/h2-4,6-11,18H,5,12-17H2,1H3,(H,24,27)