3-methyl-5-[4-(5-methyl-2-propan-2-yl-phenoxy)butyl]-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 3-methyl-5-[4-(5-methyl-2-propan-2-yl-phenoxy)butyl]-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-5-[4-(2-isopropyl-5-methyl-phenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-3-methyl-5-[4-(5-methyl-2-propan-2-ylphenoxy)butyl]-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-3-methyl-5-[4-(5-methyl-2-propan-2-ylphenoxy)butyl]-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-5-[4-(2-isopropyl-5-methyl-phenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C31H36N2O3 MolecularWeight: 484.62914

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=C(C=CC(=C3)C)C(C)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=C(C=CC(=C3)C)C(C)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H36N2O3/c1-22(2)26-17-16-23(3)20-29(26)36-19-11-10-18-32-27-14-8-9-15-28(27)33(21-24(4)30(32)34)31(35)25-12-6-5-7-13-25/h5-9,12-17,20,22,24H,10-11,18-19,21H2,1-4H3