7-chloranyl-3a,5-bis(phenylmethyl)-2,3-dihydro-1H-cyclopenta[c][1,5]benzodiazepin-4-one

Systemtic Name: 7-chloranyl-3a,5-bis(phenylmethyl)-2,3-dihydro-1H-cyclopenta[c][1,5]benzodiazepin-4-one Openeye Name: 3a,5-dibenzyl-7-chloro-2,3-dihydro-1H-cyclopenta[c][1,5]benzodiazepin-4-one CAS Name: 7-chloro-3a,5-bis(phenylmethyl)-2,3-dihydro-1H-cyclopenta[c][1,5]benzodiazepin-4-one IUPAC Name: 3a,5-dibenzyl-7-chloro-2,3-dihydro-1H-cyclopenta[c][1,5]benzodiazepin-4-one Traditional Name: 3a,5-dibenzyl-7-chloro-2,3-dihydro-1H-cyclopenta[c][1,5]benzodiazepin-4-one Formula: C26H23ClN2O MolecularWeight: 414.92662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=C(C=C3)Cl)N(C(=O)C2(C1)CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC2=NC3=C(C=C(C=C3)Cl)N(C(=O)C2(C1)CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H23ClN2O/c27-21-13-14-22-23(16-21)29(18-20-10-5-2-6-11-20)25(30)26(15-7-12-24(26)28-22)17-19-8-3-1-4-9-19/h1-6,8-11,13-14,16H,7,12,15,17-18H2