4-methylbenzenesulfonic acid; 1-(2-naphthalen-1-ylethylsulfonyl)piperidin-4-amine

Systemtic Name: 4-methylbenzenesulfonic acid; 1-(2-naphthalen-1-ylethylsulfonyl)piperidin-4-amine Openeye Name: 4-methylbenzenesulfonic acid; 1-[2-(1-naphthyl)ethylsulfonyl]piperidin-4-amine CAS Name: 4-methylbenzenesulfonic acid; 1-[2-(1-naphthalenyl)ethylsulfonyl]-4-piperidinamine IUPAC Name: 4-methylbenzenesulfonic acid; 1-(2-naphthalen-1-ylethylsulfonyl)piperidin-4-amine Traditional Name: [1-[2-(1-naphthyl)ethylsulfonyl]-4-piperidyl]amine; tosylic acid Formula: C24H30N2O5S2 MolecularWeight: 490.6354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(CCC1N)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(CCC1N)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H22N2O2S.C7H8O3S/c18-16-8-11-19(12-9-16)22(20,21)13-10-15-6-3-5-14-4-1-2-7-17(14)15;1-6-2-4-7(5-3-6)11(8,9)10/h1-7,16H,8-13,18H2;2-5H,1H3,(H,8,9,10)