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

Systemtic Name: 5-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-5-[2-(4-chloro-3-methyl-phenoxy)ethyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[2-(4-chloro-3-methylphenoxy)ethyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[2-(4-chloro-3-methylphenoxy)ethyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-5-[2-(4-chloro-3-methyl-phenoxy)ethyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C26H25ClN2O3 MolecularWeight: 448.9413

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCOC3=CC(=C(C=C3)Cl)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCOC3=CC(=C(C=C3)Cl)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H25ClN2O3/c1-18-16-21(12-13-22(18)27)32-15-14-28-23-10-6-7-11-24(23)29(17-19(2)25(28)30)26(31)20-8-4-3-5-9-20/h3-13,16,19H,14-15,17H2,1-2H3