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

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] (4E)-4-[(4-methoxyphenyl)methylene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-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-[(4-methoxyphenyl)methylidene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-2-methyl-4-p-anisylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2=CC=C(C=C2)OC)C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)C(=C(C)N)C#N

Isomeric SMILES

CC1C/C(=C\C2=CC=C(C=C2)OC)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)/C(=C(\C)/N)/C#N

InChI

InChI=1S/C29H27N3O4/c1-17-12-20(14-19-8-10-21(35-3)11-9-19)28-23(13-17)27(22-6-4-5-7-25(22)32-28)29(34)36-16-26(33)24(15-30)18(2)31/h4-11,14,17H,12-13,16,31H2,1-3H3/b20-14+,24-18+