[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] (4E)-4-[(3,4-dimethoxyphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-veratrylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C29H27N3O5 MolecularWeight: 497.54178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=C2CCCC(=CC3=CC(=C(C=C3)OC)OC)C2=NC4=CC=CC=C41)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=C2CCC/C(=C\C3=CC(=C(C=C3)OC)OC)/C2=NC4=CC=CC=C41)/N

InChI

InChI=1S/C29H27N3O5/c1-17(31)22(15-30)24(33)16-37-29(34)27-20-8-4-5-10-23(20)32-28-19(7-6-9-21(27)28)13-18-11-12-25(35-2)26(14-18)36-3/h4-5,8,10-14H,6-7,9,16,31H2,1-3H3/b19-13+,22-17+