2-[(4-chloranylphenoxy)methyl]-8-methoxy-3-[3-(1-phenethylpiperidin-4-yl)propyl]quinazolin-4-one

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-8-methoxy-3-[3-(1-phenethylpiperidin-4-yl)propyl]quinazolin-4-one Openeye Name: 2-[(4-chlorophenoxy)methyl]-8-methoxy-3-[3-(1-phenethyl-4-piperidyl)propyl]quinazolin-4-one CAS Name: 2-[(4-chlorophenoxy)methyl]-8-methoxy-3-[3-(1-phenethyl-4-piperidinyl)propyl]-4-quinazolinone IUPAC Name: 2-[(4-chlorophenoxy)methyl]-8-methoxy-3-[3-(1-phenethylpiperidin-4-yl)propyl]quinazolin-4-one Traditional Name: 2-[(4-chlorophenoxy)methyl]-8-methoxy-3-[3-(1-phenethyl-4-piperidyl)propyl]quinazolin-4-one Formula: C32H36ClN3O3 MolecularWeight: 546.09954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(N(C2=O)CCCC3CCN(CC3)CCC4=CC=CC=C4)COC5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC=CC2=C1N=C(N(C2=O)CCCC3CCN(CC3)CCC4=CC=CC=C4)COC5=CC=C(C=C5)Cl

InChI

InChI=1S/C32H36ClN3O3/c1-38-29-11-5-10-28-31(29)34-30(23-39-27-14-12-26(33)13-15-27)36(32(28)37)19-6-9-25-17-21-35(22-18-25)20-16-24-7-3-2-4-8-24/h2-5,7-8,10-15,25H,6,9,16-23H2,1H3