4-methoxy-6-[2-(6-methoxy-6-phenylmethoxy-cyclohexa-2,4-dien-1-yl)ethynyl]quinazoline

Systemtic Name: 4-methoxy-6-[2-(6-methoxy-6-phenylmethoxy-cyclohexa-2,4-dien-1-yl)ethynyl]quinazoline Openeye Name: 6-[2-(6-benzyloxy-6-methoxy-cyclohexa-2,4-dien-1-yl)ethynyl]-4-methoxy-quinazoline CAS Name: 4-methoxy-6-[2-(6-methoxy-6-phenylmethoxy-1-cyclohexa-2,4-dienyl)ethynyl]quinazoline IUPAC Name: 4-methoxy-6-[2-(6-methoxy-6-phenylmethoxycyclohexa-2,4-dien-1-yl)ethynyl]quinazoline Traditional Name: 6-[2-(6-benzoxy-6-methoxy-cyclohexa-2,4-dien-1-yl)ethynyl]-4-methoxy-quinazoline Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC2=C1C=C(C=C2)C#CC3C=CC=CC3(OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=NC=NC2=C1C=C(C=C2)C#CC3C=CC=CC3(OC)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3/c1-28-24-22-16-19(12-14-23(22)26-18-27-24)11-13-21-10-6-7-15-25(21,29-2)30-17-20-8-4-3-5-9-20/h3-10,12,14-16,18,21H,17H2,1-2H3