1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one Openeye Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-(o-tolylmethyl)-1,4-diazepan-5-one CAS Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one Traditional Name: 1-(coumaran-5-ylmethyl)-4-(2-methylbenzyl)-1,4-diazepan-5-one Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CCC2=O)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CCC2=O)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C22H26N2O2/c1-17-4-2-3-5-20(17)16-24-12-11-23(10-8-22(24)25)15-18-6-7-21-19(14-18)9-13-26-21/h2-7,14H,8-13,15-16H2,1H3