N-[1-(2-dimethylaminoethyl)indol-5-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[1-(2-dimethylaminoethyl)indol-5-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[1-(2-dimethylaminoethyl)indol-5-yl]-3-nitro-benzenesulfonamide CAS Name: N-[1-(2-dimethylaminoethyl)-5-indolyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-(2-dimethylaminoethyl)indol-5-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-(2-dimethylaminoethyl)indol-5-yl]-3-nitro-benzenesulfonamide Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C=CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCN1C=CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O4S/c1-20(2)10-11-21-9-8-14-12-15(6-7-18(14)21)19-27(25,26)17-5-3-4-16(13-17)22(23)24/h3-9,12-13,19H,10-11H2,1-2H3