ethyl 4-[(Z)-(1-ethylquinolin-4-ylidene)methyl]-3-nitro-benzoate

Systemtic Name: ethyl 4-[(Z)-(1-ethylquinolin-4-ylidene)methyl]-3-nitro-benzoate Openeye Name: ethyl 4-[(Z)-(1-ethyl-4-quinolylidene)methyl]-3-nitro-benzoate CAS Name: 4-[(Z)-(1-ethyl-4-quinolinylidene)methyl]-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-[(Z)-(1-ethylquinolin-4-ylidene)methyl]-3-nitrobenzoate Traditional Name: 4-[(Z)-(1-ethyl-4-quinolylidene)methyl]-3-nitro-benzoic acid ethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=CC2=C(C=C(C=C2)C(=O)OCC)[N+](=O)[O-])C3=CC=CC=C31

Isomeric SMILES

CCN1C=C/C(=C/C2=C(C=C(C=C2)C(=O)OCC)[N+](=O)[O-])/C3=CC=CC=C31

InChI

InChI=1S/C21H20N2O4/c1-3-22-12-11-15(18-7-5-6-8-19(18)22)13-16-9-10-17(21(24)27-4-2)14-20(16)23(25)26/h5-14H,3-4H2,1-2H3/b15-13-