3-[2-(hydroxymethyl)-4-methoxy-phenyl]-6-methoxy-4-oxidanylidene-2H-quinazoline-1-carbaldehyde

Systemtic Name: 3-[2-(hydroxymethyl)-4-methoxy-phenyl]-6-methoxy-4-oxidanylidene-2H-quinazoline-1-carbaldehyde Openeye Name: 3-[2-(hydroxymethyl)-4-methoxy-phenyl]-6-methoxy-4-oxo-2H-quinazoline-1-carbaldehyde CAS Name: 3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxy-4-oxo-2H-quinazoline-1-carboxaldehyde IUPAC Name: 3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxy-4-oxo-2H-quinazoline-1-carbaldehyde Traditional Name: 4-keto-6-methoxy-3-(4-methoxy-2-methylol-phenyl)-2H-quinazoline-1-carbaldehyde Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CN(C3=C(C2=O)C=C(C=C3)OC)C=O)CO

Isomeric SMILES

COC1=CC(=C(C=C1)N2CN(C3=C(C2=O)C=C(C=C3)OC)C=O)CO

InChI

InChI=1S/C18H18N2O5/c1-24-13-3-5-16(12(7-13)9-21)20-10-19(11-22)17-6-4-14(25-2)8-15(17)18(20)23/h3-8,11,21H,9-10H2,1-2H3