4-[4-(phenylmethyl)piperidin-1-yl]-2-(4-propoxyphenyl)quinazoline

Systemtic Name: 4-[4-(phenylmethyl)piperidin-1-yl]-2-(4-propoxyphenyl)quinazoline Openeye Name: 4-(4-benzyl-1-piperidyl)-2-(4-propoxyphenyl)quinazoline CAS Name: 4-[4-(phenylmethyl)-1-piperidinyl]-2-(4-propoxyphenyl)quinazoline IUPAC Name: 4-(4-benzylpiperidin-1-yl)-2-(4-propoxyphenyl)quinazoline Traditional Name: 4-(4-benzylpiperidino)-2-(4-propoxyphenyl)quinazoline Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O/c1-2-20-33-25-14-12-24(13-15-25)28-30-27-11-7-6-10-26(27)29(31-28)32-18-16-23(17-19-32)21-22-8-4-3-5-9-22/h3-15,23H,2,16-21H2,1H3