ethyl 1-tert-butyl-7-(2,3-dihydroindol-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-tert-butyl-7-(2,3-dihydroindol-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-tert-butyl-7-indolin-1-yl-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 1-tert-butyl-7-(2,3-dihydroindol-1-yl)-6-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-tert-butyl-7-(2,3-dihydroindol-1-yl)-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 1-tert-butyl-7-indolin-1-yl-4-keto-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)[N+](=O)[O-])N3CCC4=CC=CC=C43)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)[N+](=O)[O-])N3CCC4=CC=CC=C43)C(C)(C)C

InChI

InChI=1S/C24H25N3O5/c1-5-32-23(29)17-14-26(24(2,3)4)19-13-20(21(27(30)31)12-16(19)22(17)28)25-11-10-15-8-6-7-9-18(15)25/h6-9,12-14H,5,10-11H2,1-4H3