diethyl 2-azanyl-3-cyano-4-methyl-4,6-bis(5-nitro-1-benzofuran-2-yl)cyclohexa-1,5-diene-1,3-dicarboxylate

Systemtic Name: diethyl 2-azanyl-3-cyano-4-methyl-4,6-bis(5-nitro-1-benzofuran-2-yl)cyclohexa-1,5-diene-1,3-dicarboxylate Openeye Name: diethyl 2-amino-3-cyano-4-methyl-4,6-bis(5-nitrobenzofuran-2-yl)cyclohexa-1,5-diene-1,3-dicarboxylate CAS Name: 2-amino-3-cyano-4-methyl-4,6-bis(5-nitro-2-benzofuranyl)cyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-3-cyano-4-methyl-4,6-bis(5-nitro-1-benzofuran-2-yl)cyclohexa-1,5-diene-1,3-dicarboxylate Traditional Name: 2-amino-3-cyano-4-methyl-4,6-bis(5-nitrobenzofuran-2-yl)cyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester Formula: C30H24N4O10 MolecularWeight: 600.53236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(C(C=C1C2=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])(C)C4=CC5=C(O4)C=CC(=C5)[N+](=O)[O-])(C#N)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(C(C(C=C1C2=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])(C)C4=CC5=C(O4)C=CC(=C5)[N+](=O)[O-])(C#N)C(=O)OCC)N

InChI

InChI=1S/C30H24N4O10/c1-4-41-27(35)25-20(23-12-16-10-18(33(37)38)6-8-21(16)43-23)14-29(3,30(15-31,26(25)32)28(36)42-5-2)24-13-17-11-19(34(39)40)7-9-22(17)44-24/h6-14H,4-5,32H2,1-3H3