1-[6-[4-(azepan-1-ylmethyl)piperidin-1-yl]sulfonyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone

Systemtic Name: 1-[6-[4-(azepan-1-ylmethyl)piperidin-1-yl]sulfonyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Openeye Name: 1-[6-[[4-(azepan-1-ylmethyl)-1-piperidyl]sulfonyl]-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone CAS Name: 1-[6-[[4-(1-azepanylmethyl)-1-piperidinyl]sulfonyl]-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone IUPAC Name: 1-[6-[4-(azepan-1-ylmethyl)piperidin-1-yl]sulfonyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Traditional Name: 1-[6-[4-(azepan-1-ylmethyl)piperidino]sulfonyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)CN4CCCCCC4)C(=O)C

Isomeric SMILES

CC1CN(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)CN4CCCCCC4)C(=O)C

InChI

InChI=1S/C23H35N3O4S/c1-18-16-26(19(2)27)22-15-21(7-8-23(22)30-18)31(28,29)25-13-9-20(10-14-25)17-24-11-5-3-4-6-12-24/h7-8,15,18,20H,3-6,9-14,16-17H2,1-2H3