5-(azepan-1-yl)-1-ethyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 5-(azepan-1-yl)-1-ethyl-3H-1,4-benzodiazepin-2-one Openeye Name: 5-(azepan-1-yl)-1-ethyl-3H-1,4-benzodiazepin-2-one CAS Name: 5-(1-azepanyl)-1-ethyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(azepan-1-yl)-1-ethyl-3H-1,4-benzodiazepin-2-one Traditional Name: 5-(azepan-1-yl)-1-ethyl-3H-1,4-benzodiazepin-2-one Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CN=C(C2=CC=CC=C21)N3CCCCCC3

Isomeric SMILES

CCN1C(=O)CN=C(C2=CC=CC=C21)N3CCCCCC3

InChI

InChI=1S/C17H23N3O/c1-2-20-15-10-6-5-9-14(15)17(18-13-16(20)21)19-11-7-3-4-8-12-19/h5-6,9-10H,2-4,7-8,11-13H2,1H3