8-chloranyl-4-[3-(6-methoxypyridin-3-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-chloranyl-4-[3-(6-methoxypyridin-3-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-chloro-4-[3-(6-methoxy-3-pyridyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-chloro-4-[3-(6-methoxy-3-pyridinyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-chloro-4-[3-(6-methoxypyridin-3-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-chloro-4-[3-(6-methoxy-3-pyridyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C=C4)Cl)NC(=O)C3

Isomeric SMILES

COC1=NC=C(C=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C=C4)Cl)NC(=O)C3

InChI

InChI=1S/C21H16ClN3O2/c1-27-21-8-5-15(12-23-21)13-3-2-4-14(9-13)18-11-20(26)25-19-10-16(22)6-7-17(19)24-18/h2-10,12H,11H2,1H3,(H,25,26)