6-methyl-7-nitro-1-octyl-2,3-dihydroindole-5-carboxylic acid

Systemtic Name: 6-methyl-7-nitro-1-octyl-2,3-dihydroindole-5-carboxylic acid Openeye Name: 6-methyl-7-nitro-1-octyl-indoline-5-carboxylic acid CAS Name: 6-methyl-7-nitro-1-octyl-2,3-dihydroindole-5-carboxylic acid IUPAC Name: 6-methyl-7-nitro-1-octyl-2,3-dihydroindole-5-carboxylic acid Traditional Name: 6-methyl-7-nitro-1-octyl-indoline-5-carboxylic acid Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCC2=C1C(=C(C(=C2)C(=O)O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCN1CCC2=C1C(=C(C(=C2)C(=O)O)C)[N+](=O)[O-]

InChI

InChI=1S/C18H26N2O4/c1-3-4-5-6-7-8-10-19-11-9-14-12-15(18(21)22)13(2)16(17(14)19)20(23)24/h12H,3-11H2,1-2H3,(H,21,22)