ethyl (E)-3-[[2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[2-[(4-chloro-3-nitro-phenyl)sulfonylamino]anilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[2-[(4-chloro-3-nitrophenyl)sulfonylamino]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-[(4-chloro-3-nitrophenyl)sulfonylamino]anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[2-[(4-chloro-3-nitro-phenyl)sulfonylamino]anilino]-2-cyano-acrylic acid ethyl ester Formula: C18H15ClN4O6S MolecularWeight: 450.8529

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H15ClN4O6S/c1-2-29-18(24)12(10-20)11-21-15-5-3-4-6-16(15)22-30(27,28)13-7-8-14(19)17(9-13)23(25)26/h3-9,11,21-22H,2H2,1H3/b12-11+