6-(naphthalen-2-ylmethyl)-3-[(1S,2S)-2-oxidanylcyclohexyl]benzo[h]quinazolin-4-one

Systemtic Name: 6-(naphthalen-2-ylmethyl)-3-[(1S,2S)-2-oxidanylcyclohexyl]benzo[h]quinazolin-4-one Openeye Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-(2-naphthylmethyl)benzo[h]quinazolin-4-one CAS Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-(2-naphthalenylmethyl)-4-benzo[h]quinazolinone IUPAC Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-(naphthalen-2-ylmethyl)benzo[h]quinazolin-4-one Traditional Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-(2-naphthylmethyl)benzo[h]quinazolin-4-one Formula: C29H26N2O2 MolecularWeight: 434.52894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N2C=NC3=C(C2=O)C=C(C4=CC=CC=C43)CC5=CC6=CC=CC=C6C=C5)O

Isomeric SMILES

C1CC[C@@H]([C@H](C1)N2C=NC3=C(C2=O)C=C(C4=CC=CC=C43)CC5=CC6=CC=CC=C6C=C5)O

InChI

InChI=1S/C29H26N2O2/c32-27-12-6-5-11-26(27)31-18-30-28-24-10-4-3-9-23(24)22(17-25(28)29(31)33)16-19-13-14-20-7-1-2-8-21(20)15-19/h1-4,7-10,13-15,17-18,26-27,32H,5-6,11-12,16H2/t26-,27-/m0/s1