3-[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-(2-methoxy-5-nitro-anilino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-(2-methoxy-5-nitroanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-(2-methoxy-5-nitroanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-keto-2-(2-methoxy-5-nitro-anilino)ethyl]-1H-indole-2-carboxylic acid Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C18H15N3O6/c1-27-15-7-6-10(21(25)26)8-14(15)19-16(22)9-12-11-4-2-3-5-13(11)20-17(12)18(23)24/h2-8,20H,9H2,1H3,(H,19,22)(H,23,24)