[4-[(E)-[3-(dimethylaminomethyl)-2-oxidanylidene-cyclohexylidene]methyl]phenyl] benzoate

Systemtic Name: [4-[(E)-[3-(dimethylaminomethyl)-2-oxidanylidene-cyclohexylidene]methyl]phenyl] benzoate Openeye Name: [4-[(E)-[3-(dimethylaminomethyl)-2-oxo-cyclohexylidene]methyl]phenyl] benzoate CAS Name: benzoic acid [4-[(E)-[3-(dimethylaminomethyl)-2-oxocyclohexylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[3-(dimethylaminomethyl)-2-oxocyclohexylidene]methyl]phenyl] benzoate Traditional Name: benzoic acid [4-[(E)-[3-(dimethylaminomethyl)-2-keto-cyclohexylidene]methyl]phenyl] ester Formula: C23H25NO3 MolecularWeight: 363.4495

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCC(=CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C1=O

Isomeric SMILES

CN(C)CC1CCC/C(=C\C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)/C1=O

InChI

InChI=1S/C23H25NO3/c1-24(2)16-20-10-6-9-19(22(20)25)15-17-11-13-21(14-12-17)27-23(26)18-7-4-3-5-8-18/h3-5,7-8,11-15,20H,6,9-10,16H2,1-2H3/b19-15+