ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxidanylidene-prop-1-enyl]-5-nitro-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxidanylidene-prop-1-enyl]-5-nitro-1H-indole-2-carboxylate Openeye Name: ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxo-prop-1-enyl]-5-nitro-1H-indole-2-carboxylate CAS Name: 3-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-5-nitro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-5-nitro-1H-indole-2-carboxylate Traditional Name: 3-[(Z)-2-acetamido-3-keto-3-methoxy-prop-1-enyl]-5-nitro-1H-indole-2-carboxylic acid ethyl ester Formula: C17H17N3O7 MolecularWeight: 375.33278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=C(C(=O)OC)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])/C=C(/C(=O)OC)\NC(=O)C

InChI

InChI=1S/C17H17N3O7/c1-4-27-17(23)15-12(8-14(16(22)26-3)18-9(2)21)11-7-10(20(24)25)5-6-13(11)19-15/h5-8,19H,4H2,1-3H3,(H,18,21)/b14-8-