(6R)-5-butanoyl-6-pyridin-3-yl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: (6R)-5-butanoyl-6-pyridin-3-yl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: (6R)-5-butanoyl-6-(3-pyridyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: (6R)-5-(1-oxobutyl)-6-(3-pyridinyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: (6R)-5-butanoyl-6-pyridin-3-yl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: (6R)-5-butyryl-6-(3-pyridyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CN=CC=C4

Isomeric SMILES

CCCC(=O)N1[C@@H](C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CN=CC=C4

InChI

InChI=1S/C22H23N3O2/c1-2-7-20(27)25-18-11-4-3-9-16(18)24-17-10-5-12-19(26)21(17)22(25)15-8-6-13-23-14-15/h3-4,6,8-9,11,13-14,22,24H,2,5,7,10,12H2,1H3/t22-/m1/s1