[4-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-6-yl] benzenesulfonate

Systemtic Name: [4-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-6-yl] benzenesulfonate Openeye Name: [4-(1-methyl-4-piperidyl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-6-yl] benzenesulfonate CAS Name: benzenesulfonic acid [4-(1-methyl-4-piperidinyl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-6-yl] ester IUPAC Name: [4-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-6-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-(1-methyl-4-piperidyl)-2,3-dihydro-1H-pyrrol[1,2-a]indol-6-yl] ester Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=C3CCCN3C4=C2C=C(C=C4)OS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CN1CCC(CC1)C2=C3CCCN3C4=C2C=C(C=C4)OS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H26N2O3S/c1-24-14-11-17(12-15-24)23-20-16-18(9-10-21(20)25-13-5-8-22(23)25)28-29(26,27)19-6-3-2-4-7-19/h2-4,6-7,9-10,16-17H,5,8,11-15H2,1H3