[4-(4-methylpiperidin-1-yl)sulfonylphenyl]methyl-propan-2-yl-azanium

Systemtic Name: [4-(4-methylpiperidin-1-yl)sulfonylphenyl]methyl-propan-2-yl-azanium Openeye Name: isopropyl-[[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]methyl]ammonium CAS Name: [4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]methyl-propan-2-ylammonium IUPAC Name: [4-(4-methylpiperidin-1-yl)sulfonylphenyl]methyl-propan-2-ylazanium Traditional Name: isopropyl-[4-(4-methylpiperidino)sulfonylbenzyl]ammonium Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C[NH2+]C(C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C[NH2+]C(C)C

InChI

InChI=1S/C16H26N2O2S/c1-13(2)17-12-15-4-6-16(7-5-15)21(19,20)18-10-8-14(3)9-11-18/h4-7,13-14,17H,8-12H2,1-3H3/p+1