8-chloranyl-7-ethoxy-4-(3-pyridin-3-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-chloranyl-7-ethoxy-4-(3-pyridin-3-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-chloro-7-ethoxy-4-[3-(3-pyridyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-chloro-7-ethoxy-4-[3-(3-pyridinyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-chloro-7-ethoxy-4-(3-pyridin-3-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-chloro-7-ethoxy-4-[3-(3-pyridyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=C(CC(=O)N2)C3=CC=CC(=C3)C4=CN=CC=C4)Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=C(CC(=O)N2)C3=CC=CC(=C3)C4=CN=CC=C4)Cl

InChI

InChI=1S/C22H18ClN3O2/c1-2-28-21-11-20-19(10-17(21)23)26-22(27)12-18(25-20)15-6-3-5-14(9-15)16-7-4-8-24-13-16/h3-11,13H,2,12H2,1H3,(H,26,27)