N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,7-dimethyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4,7-dimethylquinazolin-2-yl)-N-homoveratryl-isonipecotamide Formula: C26H32N4O3 MolecularWeight: 448.55728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C26H32N4O3/c1-17-5-7-21-18(2)28-26(29-22(21)15-17)30-13-10-20(11-14-30)25(31)27-12-9-19-6-8-23(32-3)24(16-19)33-4/h5-8,15-16,20H,9-14H2,1-4H3,(H,27,31)