[4-(dimethylaminomethyl)phenyl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone hydrochloride

Systemtic Name: [4-(dimethylaminomethyl)phenyl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone hydrochloride Openeye Name: [4-(dimethylaminomethyl)phenyl]-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone hydrochloride CAS Name: [4-(dimethylaminomethyl)phenyl]-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: [4-(dimethylaminomethyl)phenyl]-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone hydrochloride Traditional Name: [4-(dimethylaminomethyl)phenyl]-[4-(2-naphthylsulfonyl)piperazino]methanone hydrochloride Formula: C24H28ClN3O3S MolecularWeight: 474.01542

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3.Cl

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3.Cl

InChI

InChI=1S/C24H27N3O3S.ClH/c1-25(2)18-19-7-9-21(10-8-19)24(28)26-13-15-27(16-14-26)31(29,30)23-12-11-20-5-3-4-6-22(20)17-23;/h3-12,17H,13-16,18H2,1-2H3;1H