3-[(2S)-2-(4-chlorophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one

Systemtic Name: 3-[(2S)-2-(4-chlorophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Openeye Name: 3-[(2S)-2-(4-chlorophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one CAS Name: 3-[(2S)-2-(4-chlorophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]-1-benzopyran-2-one IUPAC Name: 3-[(2S)-2-(4-chlorophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Traditional Name: 3-[(2S)-2-(4-chlorophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]coumarin Formula: C24H17ClN2O2 MolecularWeight: 400.85698

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1[C@H](NC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H17ClN2O2/c25-17-11-9-15(10-12-17)21-14-22(27-20-7-3-2-6-19(20)26-21)18-13-16-5-1-4-8-23(16)29-24(18)28/h1-13,21,26H,14H2/t21-/m0/s1