6-[(4-methoxyphenyl)methyl]-3-[(1S,2S)-2-oxidanylcyclopentyl]benzo[h]quinazolin-4-one

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-3-[(1S,2S)-2-oxidanylcyclopentyl]benzo[h]quinazolin-4-one Openeye Name: 3-[(1S,2S)-2-hydroxycyclopentyl]-6-[(4-methoxyphenyl)methyl]benzo[h]quinazolin-4-one CAS Name: 3-[(1S,2S)-2-hydroxycyclopentyl]-6-[(4-methoxyphenyl)methyl]-4-benzo[h]quinazolinone IUPAC Name: 3-[(1S,2S)-2-hydroxycyclopentyl]-6-[(4-methoxyphenyl)methyl]benzo[h]quinazolin-4-one Traditional Name: 3-[(1S,2S)-2-hydroxycyclopentyl]-6-p-anisyl-benzo[h]quinazolin-4-one Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=CC3=C(C4=CC=CC=C42)N=CN(C3=O)C5CCCC5O

Isomeric SMILES

COC1=CC=C(C=C1)CC2=CC3=C(C4=CC=CC=C42)N=CN(C3=O)[C@H]5CCC[C@@H]5O

InChI

InChI=1S/C25H24N2O3/c1-30-18-11-9-16(10-12-18)13-17-14-21-24(20-6-3-2-5-19(17)20)26-15-27(25(21)29)22-7-4-8-23(22)28/h2-3,5-6,9-12,14-15,22-23,28H,4,7-8,13H2,1H3/t22-,23-/m0/s1