diethyl 2-azanyl-1-cyano-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylate

Systemtic Name: diethyl 2-azanyl-1-cyano-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylate Openeye Name: diethyl 2-amino-1-cyano-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylate CAS Name: 2-amino-1-cyano-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-1-cyano-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylate Traditional Name: 2-amino-1-cyano-6,7,8,9-tetrahydro-5H-benzocycloheptene-3,4-dicarboxylic acid diethyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCCCC2=C(C(=C1C(=O)OCC)N)C#N

Isomeric SMILES

CCOC(=O)C1=C2CCCCCC2=C(C(=C1C(=O)OCC)N)C#N

InChI

InChI=1S/C18H22N2O4/c1-3-23-17(21)14-12-9-7-5-6-8-11(12)13(10-19)16(20)15(14)18(22)24-4-2/h3-9,20H2,1-2H3