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

Systemtic Name: 5-[3-(2-methoxyphenoxy)propyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-5-[3-(2-methoxyphenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[3-(2-methoxyphenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[3-(2-methoxyphenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-5-[3-(2-methoxyphenoxy)propyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCCOC3=CC=CC=C3OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCOC3=CC=CC=C3OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O4/c1-20-19-29(27(31)21-11-4-3-5-12-21)23-14-7-6-13-22(23)28(26(20)30)17-10-18-33-25-16-9-8-15-24(25)32-2/h3-9,11-16,20H,10,17-19H2,1-2H3