3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-diethylaminoethyl)benzamide hydrochloride

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-diethylaminoethyl)benzamide hydrochloride Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-diethylaminoethyl)benzamide hydrochloride CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(2-diethylaminoethyl)benzamide hydrochloride IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-diethylaminoethyl)benzamide hydrochloride Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-diethylaminoethyl)benzamide hydrochloride Formula: C19H31Cl2N3O3S MolecularWeight: 452.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2.Cl

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2.Cl

InChI

InChI=1S/C19H30ClN3O3S.ClH/c1-3-22(4-2)14-11-21-19(24)16-9-10-17(20)18(15-16)27(25,26)23-12-7-5-6-8-13-23;/h9-10,15H,3-8,11-14H2,1-2H3,(H,21,24);1H