1-[4-(1,2-benzoxazol-3-ylmethyl)-1,4-diazepan-1-yl]-2-(4-methoxyphenyl)ethanone

Systemtic Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)-1,4-diazepan-1-yl]-2-(4-methoxyphenyl)ethanone Openeye Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)-1,4-diazepan-1-yl]-2-(4-methoxyphenyl)ethanone CAS Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)-1,4-diazepan-1-yl]-2-(4-methoxyphenyl)ethanone IUPAC Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)-1,4-diazepan-1-yl]-2-(4-methoxyphenyl)ethanone Traditional Name: 1-[4-(indoxazen-3-ylmethyl)-1,4-diazepan-1-yl]-2-(4-methoxyphenyl)ethanone Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N2CCCN(CC2)CC3=NOC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N2CCCN(CC2)CC3=NOC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O3/c1-27-18-9-7-17(8-10-18)15-22(26)25-12-4-11-24(13-14-25)16-20-19-5-2-3-6-21(19)28-23-20/h2-3,5-10H,4,11-16H2,1H3