(2-chloranylquinolin-3-yl)methyl 2-azanyl-5-nitro-benzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 2-azanyl-5-nitro-benzoate Openeye Name: (2-chloro-3-quinolyl)methyl 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C17H12ClN3O4 MolecularWeight: 357.74788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N

InChI

InChI=1S/C17H12ClN3O4/c18-16-11(7-10-3-1-2-4-15(10)20-16)9-25-17(22)13-8-12(21(23)24)5-6-14(13)19/h1-8H,9,19H2