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

Systemtic Name: 5-[4-(2-chloranylphenoxy)butyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-5-[4-(2-chlorophenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[4-(2-chlorophenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[4-(2-chlorophenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-5-[4-(2-chlorophenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C27H27ClN2O3 MolecularWeight: 462.96788

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=CC=CC=C3Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=CC=CC=C3Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27ClN2O3/c1-20-19-30(27(32)21-11-3-2-4-12-21)24-15-7-6-14-23(24)29(26(20)31)17-9-10-18-33-25-16-8-5-13-22(25)28/h2-8,11-16,20H,9-10,17-19H2,1H3