6-[(2,3-dimethylphenyl)amino]-6-(1-pyridin-3-ylpropyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 6-[(2,3-dimethylphenyl)amino]-6-(1-pyridin-3-ylpropyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: 6-(2,3-dimethylanilino)-6-[1-(3-pyridyl)propyl]cyclohexa-2,4-diene-1-carboxylate CAS Name: 6-(2,3-dimethylanilino)-6-[1-(3-pyridinyl)propyl]-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 6-(2,3-dimethylanilino)-6-(1-pyridin-3-ylpropyl)cyclohexa-2,4-diene-1-carboxylate Traditional Name: 6-(2,3-dimethylanilino)-6-[1-(3-pyridyl)propyl]cyclohexa-2,4-diene-1-carboxylate Formula: C23H25N2O2- MolecularWeight: 361.4568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=CC=C1)C2(C=CC=CC2C(=O)[O-])NC3=CC=CC(=C3C)C

Isomeric SMILES

CCC(C1=CN=CC=C1)C2(C=CC=CC2C(=O)[O-])NC3=CC=CC(=C3C)C

InChI

InChI=1S/C23H26N2O2/c1-4-19(18-10-8-14-24-15-18)23(13-6-5-11-20(23)22(26)27)25-21-12-7-9-16(2)17(21)3/h5-15,19-20,25H,4H2,1-3H3,(H,26,27)/p-1