3-azanyl-5-(3-methylbutyl)-3,4-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-5-(3-methylbutyl)-3,4-dihydro-1,4-benzodiazepin-2-one Openeye Name: 3-amino-5-isopentyl-3,4-dihydro-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-(3-methylbutyl)-3,4-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-(3-methylbutyl)-3,4-dihydro-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-isoamyl-3,4-dihydro-1,4-benzodiazepin-2-one Formula: C14H19N3O MolecularWeight: 245.32016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C2C=CC=CC2=NC(=O)C(N1)N

Isomeric SMILES

CC(C)CCC1=C2C=CC=CC2=NC(=O)C(N1)N

InChI

InChI=1S/C14H19N3O/c1-9(2)7-8-12-10-5-3-4-6-11(10)17-14(18)13(15)16-12/h3-6,9,13,16H,7-8,15H2,1-2H3