ethyl (1E)-N-[4-(4-chloranyl-3-nitro-phenyl)-3-cyano-4H-benzo[h]chromen-2-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[4-(4-chloranyl-3-nitro-phenyl)-3-cyano-4H-benzo[h]chromen-2-yl]methanimidate Openeye Name: ethyl (1E)-N-[4-(4-chloro-3-nitro-phenyl)-3-cyano-4H-benzo[h]chromen-2-yl]methanimidate CAS Name: (1E)-N-[4-(4-chloro-3-nitrophenyl)-3-cyano-4H-benzo[h][1]benzopyran-2-yl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-[4-(4-chloro-3-nitrophenyl)-3-cyano-4H-benzo[h]chromen-2-yl]methanimidate Traditional Name: (1E)-N-[4-(4-chloro-3-nitro-phenyl)-3-cyano-4H-benzo[h]chromen-2-yl]formimidic acid ethyl ester Formula: C23H16ClN3O4 MolecularWeight: 433.84384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(C(C2=C(O1)C3=CC=CC=C3C=C2)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CCO/C=N/C1=C(C(C2=C(O1)C3=CC=CC=C3C=C2)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C23H16ClN3O4/c1-2-30-13-26-23-18(12-25)21(15-8-10-19(24)20(11-15)27(28)29)17-9-7-14-5-3-4-6-16(14)22(17)31-23/h3-11,13,21H,2H2,1H3/b26-13+