1-[4-[(4-cyclopropylcarbonylmorpholin-2-yl)methyl]-1,4-diazepan-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-[(4-cyclopropylcarbonylmorpholin-2-yl)methyl]-1,4-diazepan-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-[[4-(cyclopropanecarbonyl)morpholin-2-yl]methyl]-1,4-diazepan-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-[[4-[cyclopropyl(oxo)methyl]-2-morpholinyl]methyl]-1,4-diazepan-1-yl]-2-phenoxyethanone IUPAC Name: 1-[4-[[4-(cyclopropanecarbonyl)morpholin-2-yl]methyl]-1,4-diazepan-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-[[4-(cyclopropanecarbonyl)morpholin-2-yl]methyl]-1,4-diazepan-1-yl]-2-phenoxy-ethanone Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)COC2=CC=CC=C2)CC3CN(CCO3)C(=O)C4CC4

Isomeric SMILES

C1CN(CCN(C1)C(=O)COC2=CC=CC=C2)CC3CN(CCO3)C(=O)C4CC4

InChI

InChI=1S/C22H31N3O4/c26-21(17-29-19-5-2-1-3-6-19)24-10-4-9-23(11-12-24)15-20-16-25(13-14-28-20)22(27)18-7-8-18/h1-3,5-6,18,20H,4,7-17H2