diethyl 4-[(2-methoxy-5-nitro-phenyl)amino]quinoline-3,6-dicarboxylate

Systemtic Name: diethyl 4-[(2-methoxy-5-nitro-phenyl)amino]quinoline-3,6-dicarboxylate Openeye Name: diethyl 4-(2-methoxy-5-nitro-anilino)quinoline-3,6-dicarboxylate CAS Name: 4-(2-methoxy-5-nitroanilino)quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(2-methoxy-5-nitroanilino)quinoline-3,6-dicarboxylate Traditional Name: 4-(2-methoxy-5-nitro-anilino)quinoline-3,6-dicarboxylic acid diethyl ester Formula: C22H21N3O7 MolecularWeight: 439.41804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H21N3O7/c1-4-31-21(26)13-6-8-17-15(10-13)20(16(12-23-17)22(27)32-5-2)24-18-11-14(25(28)29)7-9-19(18)30-3/h6-12H,4-5H2,1-3H3,(H,23,24)