benzenesulfonic acid; ethyl N-methyl-N-[[4-(phenylmethyl)piperidin-4-yl]methyl]carbamate

Systemtic Name: benzenesulfonic acid; ethyl N-methyl-N-[[4-(phenylmethyl)piperidin-4-yl]methyl]carbamate Openeye Name: benzenesulfonic acid; ethyl N-[(4-benzyl-4-piperidyl)methyl]-N-methyl-carbamate CAS Name: benzenesulfonic acid; N-methyl-N-[[4-(phenylmethyl)-4-piperidinyl]methyl]carbamic acid ethyl ester IUPAC Name: benzenesulfonic acid; ethyl N-[(4-benzylpiperidin-4-yl)methyl]-N-methylcarbamate Traditional Name: N-[(4-benzyl-4-piperidyl)methyl]-N-methyl-carbamic acid ethyl ester; besylic acid Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C)CC1(CCNCC1)CC2=CC=CC=C2.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)N(C)CC1(CCNCC1)CC2=CC=CC=C2.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C17H26N2O2.C6H6O3S/c1-3-21-16(20)19(2)14-17(9-11-18-12-10-17)13-15-7-5-4-6-8-15;7-10(8,9)6-4-2-1-3-5-6/h4-8,18H,3,9-14H2,1-2H3;1-5H,(H,7,8,9)