N-ethyl-4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-ethyl-4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide Openeye Name: N-ethyl-4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide CAS Name: N-ethyl-4-[[5-(2-methoxyphenyl)-2-benzofuranyl]methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-ethyl-4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide Traditional Name: N-ethyl-4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-1,4-diazepane-1-carboxamide Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCN(CC1)CC2=CC3=C(O2)C=CC(=C3)C4=CC=CC=C4OC

Isomeric SMILES

CCNC(=O)N1CCCN(CC1)CC2=CC3=C(O2)C=CC(=C3)C4=CC=CC=C4OC

InChI

InChI=1S/C24H29N3O3/c1-3-25-24(28)27-12-6-11-26(13-14-27)17-20-16-19-15-18(9-10-22(19)30-20)21-7-4-5-8-23(21)29-2/h4-5,7-10,15-16H,3,6,11-14,17H2,1-2H3,(H,25,28)