[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C3=C(CCCC3)N=C2C=C1)C(=O)OCC(=O)N(CC#N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C3=C(CCCC3)N=C2C=C1)C(=O)OCC(=O)N(CC#N)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3/c1-17-11-12-22-20(15-17)24(19-9-5-6-10-21(19)27-22)25(30)31-16-23(29)28(14-13-26)18-7-3-2-4-8-18/h2-4,7-8,11-12,15H,5-6,9-10,14,16H2,1H3