3-(2-dimethylaminoethyl)-N-(4-ethoxyphenyl)-1H-indole-5-sulfonamide hydrate hydrochloride

Systemtic Name: 3-(2-dimethylaminoethyl)-N-(4-ethoxyphenyl)-1H-indole-5-sulfonamide hydrate hydrochloride Openeye Name: 3-(2-dimethylaminoethyl)-N-(4-ethoxyphenyl)-1H-indole-5-sulfonamide hydrate hydrochloride CAS Name: 3-(2-dimethylaminoethyl)-N-(4-ethoxyphenyl)-1H-indole-5-sulfonamide hydrate hydrochloride IUPAC Name: 3-(2-dimethylaminoethyl)-N-(4-ethoxyphenyl)-1H-indole-5-sulfonamide hydrate hydrochloride Traditional Name: 3-(2-dimethylaminoethyl)-N-p-phenetyl-1H-indole-5-sulfonamide hydrate hydrochloride Formula: C20H28ClN3O4S MolecularWeight: 441.97202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC=C3CCN(C)C.O.Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC=C3CCN(C)C.O.Cl

InChI

InChI=1S/C20H25N3O3S.ClH.H2O/c1-4-26-17-7-5-16(6-8-17)22-27(24,25)18-9-10-20-19(13-18)15(14-21-20)11-12-23(2)3;;/h5-10,13-14,21-22H,4,11-12H2,1-3H3;1H;1H2