ethyl 1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-quinazolin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-quinazolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-quinazolin-4-yl]piperidine-4-carboxylate CAS Name: 1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-4-quinazolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxyquinazolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxy-quinazolin-4-yl]isonipecotic acid ethyl ester Formula: C27H33N3O6 MolecularWeight: 495.56742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=C(N=C2N3CCC(CC3)C(=O)OCC)C4=CC(=C(C=C4)OC)OC)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=C(N=C2N3CCC(CC3)C(=O)OCC)C4=CC(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C27H33N3O6/c1-6-35-24-16-20-19(15-23(24)34-5)26(30-12-10-17(11-13-30)27(31)36-7-2)29-25(28-20)18-8-9-21(32-3)22(14-18)33-4/h8-9,14-17H,6-7,10-13H2,1-5H3