ethyl 2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chloro-5-nitro-benzoyl)amino]benzothiophene-3-carboxylate CAS Name: 2-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-5-nitrobenzoyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2-chloro-5-nitro-benzoyl)amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C18H13ClN2O5S MolecularWeight: 404.82422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H13ClN2O5S/c1-2-26-18(23)15-11-5-3-4-6-14(11)27-17(15)20-16(22)12-9-10(21(24)25)7-8-13(12)19/h3-9H,2H2,1H3,(H,20,22)