1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-5-nitro-indole-2-carboxylic acid

Systemtic Name: 1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-5-nitro-indole-2-carboxylic acid Openeye Name: 1-[2-(4-chloroanilino)-2-oxo-ethyl]-5-nitro-indole-2-carboxylic acid CAS Name: 1-[2-(4-chloroanilino)-2-oxoethyl]-5-nitro-2-indolecarboxylic acid IUPAC Name: 1-[2-(4-chloroanilino)-2-oxoethyl]-5-nitroindole-2-carboxylic acid Traditional Name: 1-[2-(4-chloroanilino)-2-keto-ethyl]-5-nitro-indole-2-carboxylic acid Formula: C17H12ClN3O5 MolecularWeight: 373.74728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=C2C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=C2C(=O)O)Cl

InChI

InChI=1S/C17H12ClN3O5/c18-11-1-3-12(4-2-11)19-16(22)9-20-14-6-5-13(21(25)26)7-10(14)8-15(20)17(23)24/h1-8H,9H2,(H,19,22)(H,23,24)