4-(naphthalen-1-ylamino)-3,5-dinitro-benzoate

Systemtic Name: 4-(naphthalen-1-ylamino)-3,5-dinitro-benzoate Openeye Name: 4-(1-naphthylamino)-3,5-dinitro-benzoate CAS Name: 4-(1-naphthalenylamino)-3,5-dinitrobenzoate IUPAC Name: 4-(naphthalen-1-ylamino)-3,5-dinitrobenzoate Traditional Name: 4-(1-naphthylamino)-3,5-dinitro-benzoate Formula: C17H10N3O6- MolecularWeight: 352.2778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC3=C(C=C(C=C3[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC3=C(C=C(C=C3[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O6/c21-17(22)11-8-14(19(23)24)16(15(9-11)20(25)26)18-13-7-3-5-10-4-1-2-6-12(10)13/h1-9,18H,(H,21,22)/p-1