3-butyl-5,6-ditert-butyl-1,2-dihydro-1,4-diazepin-7-one

Systemtic Name: 3-butyl-5,6-ditert-butyl-1,2-dihydro-1,4-diazepin-7-one Openeye Name: 3-butyl-5,6-ditert-butyl-1,2-dihydro-1,4-diazepin-7-one CAS Name: 3-butyl-5,6-ditert-butyl-1,2-dihydro-1,4-diazepin-7-one IUPAC Name: 3-butyl-5,6-ditert-butyl-1,2-dihydro-1,4-diazepin-7-one Traditional Name: 3-butyl-5,6-ditert-butyl-1,2-dihydro-1,4-diazepin-7-one Formula: C17H30N2O MolecularWeight: 278.4329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=O)NC1)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCC1=NC(=C(C(=O)NC1)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C17H30N2O/c1-8-9-10-12-11-18-15(20)13(16(2,3)4)14(19-12)17(5,6)7/h8-11H2,1-7H3,(H,18,20)