N-[2-(indol-3-ylidenemethylamino)ethyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(indol-3-ylidenemethylamino)ethyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-(indol-3-ylidenemethylamino)ethyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[2-(3-indolylidenemethylamino)ethyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(indol-3-ylidenemethylamino)ethyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[2-(indol-3-ylidenemethylamino)ethyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCNC=C2C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCNC=C2C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-13-6-7-15(10-18(13)22(23)24)27(25,26)21-9-8-19-11-14-12-20-17-5-3-2-4-16(14)17/h2-7,10-12,19,21H,8-9H2,1H3