1-[6-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1,4-benzoxazin-4-yl]butan-1-one

Systemtic Name: 1-[6-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1,4-benzoxazin-4-yl]butan-1-one Openeye Name: 1-[6-[2-hydroxy-3-(isopropylamino)propoxy]-2,3-dihydro-1,4-benzoxazin-4-yl]butan-1-one CAS Name: 1-[6-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1,4-benzoxazin-4-yl]-1-butanone IUPAC Name: 1-[6-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1,4-benzoxazin-4-yl]butan-1-one Traditional Name: 1-[6-[2-hydroxy-3-(isopropylamino)propoxy]-2,3-dihydro-1,4-benzoxazin-4-yl]butan-1-one Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCOC2=C1C=C(C=C2)OCC(CNC(C)C)O

Isomeric SMILES

CCCC(=O)N1CCOC2=C1C=C(C=C2)OCC(CNC(C)C)O

InChI

InChI=1S/C18H28N2O4/c1-4-5-18(22)20-8-9-23-17-7-6-15(10-16(17)20)24-12-14(21)11-19-13(2)3/h6-7,10,13-14,19,21H,4-5,8-9,11-12H2,1-3H3