[1-[1-[4-(cycloheptylamino)-6,7-dimethoxy-quinazolin-2-yl]piperidin-4-yl]piperidin-3-yl]methanol

Systemtic Name: [1-[1-[4-(cycloheptylamino)-6,7-dimethoxy-quinazolin-2-yl]piperidin-4-yl]piperidin-3-yl]methanol Openeye Name: [1-[1-[4-(cycloheptylamino)-6,7-dimethoxy-quinazolin-2-yl]-4-piperidyl]-3-piperidyl]methanol CAS Name: [1-[1-[4-(cycloheptylamino)-6,7-dimethoxy-2-quinazolinyl]-4-piperidinyl]-3-piperidinyl]methanol IUPAC Name: [1-[1-[4-(cycloheptylamino)-6,7-dimethoxyquinazolin-2-yl]piperidin-4-yl]piperidin-3-yl]methanol Traditional Name: [1-[1-[4-(cycloheptylamino)-6,7-dimethoxy-quinazolin-2-yl]-4-piperidyl]-3-piperidyl]methanol Formula: C28H43N5O3 MolecularWeight: 497.67272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)N4CCCC(C4)CO)NC5CCCCCC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)N4CCCC(C4)CO)NC5CCCCCC5)OC

InChI

InChI=1S/C28H43N5O3/c1-35-25-16-23-24(17-26(25)36-2)30-28(31-27(23)29-21-9-5-3-4-6-10-21)32-14-11-22(12-15-32)33-13-7-8-20(18-33)19-34/h16-17,20-22,34H,3-15,18-19H2,1-2H3,(H,29,30,31)