5-[2-(4-butan-2-ylphenoxy)ethyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 5-[2-(4-butan-2-ylphenoxy)ethyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-3-methyl-5-[2-(4-sec-butylphenoxy)ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[2-(4-butan-2-ylphenoxy)ethyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[2-(4-butan-2-ylphenoxy)ethyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-3-methyl-5-[2-(4-sec-butylphenoxy)ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C29H32N2O3 MolecularWeight: 456.57598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCCN2C3=CC=CC=C3N(CC(C2=O)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCCN2C3=CC=CC=C3N(CC(C2=O)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O3/c1-4-21(2)23-14-16-25(17-15-23)34-19-18-30-26-12-8-9-13-27(26)31(20-22(3)28(30)32)29(33)24-10-6-5-7-11-24/h5-17,21-22H,4,18-20H2,1-3H3