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

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (4E)-2-methyl-4-(phenylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] (4E)-4-benzylidene-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-2-methyl-4-(phenylmethylene)-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-benzylidene-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-benzal-2-methyl-2,3-dihydro-1H-acridine-9-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C28H25N3O3 MolecularWeight: 451.5164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25N3O3/c1-17-12-20(14-19-8-4-3-5-9-19)27-22(13-17)26(21-10-6-7-11-24(21)31-27)28(33)34-16-25(32)23(15-29)18(2)30/h3-11,14,17H,12-13,16,30H2,1-2H3/b20-14+,23-18+