(E)-2-(4-chlorophenyl)sulfonyl-3-(2-methyl-5-nitro-1H-indol-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-chlorophenyl)sulfonyl-3-(2-methyl-5-nitro-1H-indol-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-chlorophenyl)sulfonyl-3-(2-methyl-5-nitro-1H-indol-3-yl)prop-2-enenitrile CAS Name: (E)-2-(4-chlorophenyl)sulfonyl-3-(2-methyl-5-nitro-1H-indol-3-yl)-2-propenenitrile IUPAC Name: (E)-2-(4-chlorophenyl)sulfonyl-3-(2-methyl-5-nitro-1H-indol-3-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-chlorophenyl)sulfonyl-3-(2-methyl-5-nitro-1H-indol-3-yl)acrylonitrile Formula: C18H12ClN3O4S MolecularWeight: 401.82358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])/C=C(\C#N)/S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H12ClN3O4S/c1-11-16(17-8-13(22(23)24)4-7-18(17)21-11)9-15(10-20)27(25,26)14-5-2-12(19)3-6-14/h2-9,21H,1H3/b15-9+