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

Systemtic Name: 5-(azepan-1-yl)-1-propyl-3H-1,4-benzodiazepin-2-one Openeye Name: 5-(azepan-1-yl)-1-propyl-3H-1,4-benzodiazepin-2-one CAS Name: 5-(1-azepanyl)-1-propyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(azepan-1-yl)-1-propyl-3H-1,4-benzodiazepin-2-one Traditional Name: 5-(azepan-1-yl)-1-propyl-3H-1,4-benzodiazepin-2-one Formula: C18H25N3O MolecularWeight: 299.4106

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)CN=C(C2=CC=CC=C21)N3CCCCCC3

Isomeric SMILES

CCCN1C(=O)CN=C(C2=CC=CC=C21)N3CCCCCC3

InChI

InChI=1S/C18H25N3O/c1-2-11-21-16-10-6-5-9-15(16)18(19-14-17(21)22)20-12-7-3-4-8-13-20/h5-6,9-10H,2-4,7-8,11-14H2,1H3