quinolin-2-ylmethyl 4-(2-methoxyethylamino)-3-nitro-benzoate

Systemtic Name: quinolin-2-ylmethyl 4-(2-methoxyethylamino)-3-nitro-benzoate Openeye Name: 2-quinolylmethyl 4-(2-methoxyethylamino)-3-nitro-benzoate CAS Name: 4-(2-methoxyethylamino)-3-nitrobenzoic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl 4-(2-methoxyethylamino)-3-nitrobenzoate Traditional Name: 4-(2-methoxyethylamino)-3-nitro-benzoic acid 2-quinolylmethyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5/c1-27-11-10-21-18-9-7-15(12-19(18)23(25)26)20(24)28-13-16-8-6-14-4-2-3-5-17(14)22-16/h2-9,12,21H,10-11,13H2,1H3