2-(3-octoxy-1-benzothiophen-2-yl)-3,1-benzoxazin-4-one

Systemtic Name: 2-(3-octoxy-1-benzothiophen-2-yl)-3,1-benzoxazin-4-one Openeye Name: 2-(3-octoxybenzothiophen-2-yl)-3,1-benzoxazin-4-one CAS Name: 2-(3-octoxy-1-benzothiophen-2-yl)-3,1-benzoxazin-4-one IUPAC Name: 2-(3-octoxy-1-benzothiophen-2-yl)-3,1-benzoxazin-4-one Traditional Name: 2-(3-octoxybenzothiophen-2-yl)-3,1-benzoxazin-4-one Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(SC2=CC=CC=C21)C3=NC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CCCCCCCCOC1=C(SC2=CC=CC=C21)C3=NC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C24H25NO3S/c1-2-3-4-5-6-11-16-27-21-18-13-8-10-15-20(18)29-22(21)23-25-19-14-9-7-12-17(19)24(26)28-23/h7-10,12-15H,2-6,11,16H2,1H3