N-(6-azanyl-1-oxidanylidene-1-piperidin-1-yl-hexan-2-yl)-4-methyl-benzenesulfonamide hydrate hydrochloride

Systemtic Name: N-(6-azanyl-1-oxidanylidene-1-piperidin-1-yl-hexan-2-yl)-4-methyl-benzenesulfonamide hydrate hydrochloride Openeye Name: N-[5-amino-1-(piperidine-1-carbonyl)pentyl]-4-methyl-benzenesulfonamide hydrate hydrochloride CAS Name: N-[6-amino-1-oxo-1-(1-piperidinyl)hexan-2-yl]-4-methylbenzenesulfonamide hydrate hydrochloride IUPAC Name: N-(6-amino-1-oxo-1-piperidin-1-ylhexan-2-yl)-4-methylbenzenesulfonamide hydrate hydrochloride Traditional Name: N-[5-amino-1-(piperidine-1-carbonyl)pentyl]-4-methyl-benzenesulfonamide hydrate hydrochloride Formula: C18H32ClN3O4S MolecularWeight: 421.98238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)N2CCCCC2.O.Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)N2CCCCC2.O.Cl

InChI

InChI=1S/C18H29N3O3S.ClH.H2O/c1-15-8-10-16(11-9-15)25(23,24)20-17(7-3-4-12-19)18(22)21-13-5-2-6-14-21;;/h8-11,17,20H,2-7,12-14,19H2,1H3;1H;1H2