4-[2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-[4-(azepane-1-carbonyl)-1-piperidyl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-[4-(azepane-1-carbonyl)piperidino]-2-keto-ethyl]-1,4-benzoxazin-3-one Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C22H29N3O4/c26-20(15-25-18-7-3-4-8-19(18)29-16-21(25)27)23-13-9-17(10-14-23)22(28)24-11-5-1-2-6-12-24/h3-4,7-8,17H,1-2,5-6,9-16H2