cyclohexyl sulfamate; 3-(1-methylpyrrolidin-2-yl)-1-(phenylmethyl)indole

Systemtic Name: cyclohexyl sulfamate; 3-(1-methylpyrrolidin-2-yl)-1-(phenylmethyl)indole Openeye Name: 1-benzyl-3-(1-methylpyrrolidin-2-yl)indole; cyclohexyl sulfamate CAS Name: 3-(1-methyl-2-pyrrolidinyl)-1-(phenylmethyl)indole; sulfamic acid cyclohexyl ester IUPAC Name: 1-benzyl-3-(1-methylpyrrolidin-2-yl)indole; cyclohexyl sulfamate Traditional Name: 1-benzyl-3-(1-methylpyrrolidin-2-yl)indole; sulfamic acid cyclohexyl ester Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4.C1CCC(CC1)OS(=O)(=O)N

Isomeric SMILES

CN1CCCC1C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4.C1CCC(CC1)OS(=O)(=O)N

InChI

InChI=1S/C20H22N2.C6H13NO3S/c1-21-13-7-12-19(21)18-15-22(14-16-8-3-2-4-9-16)20-11-6-5-10-17(18)20;7-11(8,9)10-6-4-2-1-3-5-6/h2-6,8-11,15,19H,7,12-14H2,1H3;6H,1-5H2,(H2,7,8,9)