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

Systemtic Name: 5-[3-(2-chloranylphenoxy)propyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-5-[3-(2-chlorophenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[3-(2-chlorophenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[3-(2-chlorophenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-5-[3-(2-chlorophenoxy)propyl]-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)CCCOC3=CC=CC=C3Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCOC3=CC=CC=C3Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H25ClN2O3/c1-19-18-29(26(31)20-10-3-2-4-11-20)23-14-7-6-13-22(23)28(25(19)30)16-9-17-32-24-15-8-5-12-21(24)27/h2-8,10-15,19H,9,16-18H2,1H3