5-(2,3-dihydro-1H-inden-5-ylamino)-2-nitro-benzoic acid

Systemtic Name: 5-(2,3-dihydro-1H-inden-5-ylamino)-2-nitro-benzoic acid Openeye Name: 5-(indan-5-ylamino)-2-nitro-benzoic acid CAS Name: 5-(2,3-dihydro-1H-inden-5-ylamino)-2-nitrobenzoic acid IUPAC Name: 5-(2,3-dihydro-1H-inden-5-ylamino)-2-nitrobenzoic acid Traditional Name: 5-(indan-5-ylamino)-2-nitro-benzoic acid Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC3=CC(=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC3=CC(=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H14N2O4/c19-16(20)14-9-13(6-7-15(14)18(21)22)17-12-5-4-10-2-1-3-11(10)8-12/h4-9,17H,1-3H2,(H,19,20)