[4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]-1-(3-pyridin-4-ylprop-2-ynyl)piperidin-4-yl]methanol

Systemtic Name: [4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]-1-(3-pyridin-4-ylprop-2-ynyl)piperidin-4-yl]methanol Openeye Name: [4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]-1-[3-(4-pyridyl)prop-2-ynyl]-4-piperidyl]methanol CAS Name: [4-[3-(3-chloro-6-methoxy-4-quinolinyl)propyl]-1-(3-pyridin-4-ylprop-2-ynyl)-4-piperidinyl]methanol IUPAC Name: [4-[3-(3-chloro-6-methoxyquinolin-4-yl)propyl]-1-(3-pyridin-4-ylprop-2-ynyl)piperidin-4-yl]methanol Traditional Name: [4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]-1-[3-(4-pyridyl)prop-2-ynyl]-4-piperidyl]methanol Formula: C27H30ClN3O2 MolecularWeight: 463.999

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCN(CC3)CC#CC4=CC=NC=C4)CO

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCN(CC3)CC#CC4=CC=NC=C4)CO

InChI

InChI=1S/C27H30ClN3O2/c1-33-22-6-7-26-24(18-22)23(25(28)19-30-26)5-2-10-27(20-32)11-16-31(17-12-27)15-3-4-21-8-13-29-14-9-21/h6-9,13-14,18-19,32H,2,5,10-12,15-17,20H2,1H3