N-butyl-2-[7-(2,3-dihydro-1,4-benzoxazin-4-yl)-7-oxidanylidene-heptyl]-N'-methyl-propanediamide

Systemtic Name: N-butyl-2-[7-(2,3-dihydro-1,4-benzoxazin-4-yl)-7-oxidanylidene-heptyl]-N'-methyl-propanediamide Openeye Name: N-butyl-2-[7-(2,3-dihydro-1,4-benzoxazin-4-yl)-7-oxo-heptyl]-N'-methyl-propanediamide CAS Name: N-butyl-2-[7-(2,3-dihydro-1,4-benzoxazin-4-yl)-7-oxoheptyl]-N'-methylpropanediamide IUPAC Name: N-butyl-2-[7-(2,3-dihydro-1,4-benzoxazin-4-yl)-7-oxoheptyl]-N'-methylpropanediamide Traditional Name: N-butyl-2-[7-(2,3-dihydro-1,4-benzoxazin-4-yl)-7-keto-heptyl]-N'-methyl-malonamide Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CCCCCCC(=O)N1CCOC2=CC=CC=C21)C(=O)NC

Isomeric SMILES

CCCCNC(=O)C(CCCCCCC(=O)N1CCOC2=CC=CC=C21)C(=O)NC

InChI

InChI=1S/C23H35N3O4/c1-3-4-15-25-23(29)18(22(28)24-2)11-7-5-6-8-14-21(27)26-16-17-30-20-13-10-9-12-19(20)26/h9-10,12-13,18H,3-8,11,14-17H2,1-2H3,(H,24,28)(H,25,29)