1-[(E)-6,7-dihydro-5H-1-benzothiophen-4-ylideneamino]oxy-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol

Systemtic Name: 1-[(E)-6,7-dihydro-5H-1-benzothiophen-4-ylideneamino]oxy-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol Openeye Name: 1-[(E)-6,7-dihydro-5H-benzothiophen-4-ylideneamino]oxy-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol CAS Name: 1-[(E)-6,7-dihydro-5H-1-benzothiophen-4-ylideneamino]oxy-3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propanol IUPAC Name: 1-[(E)-6,7-dihydro-5H-1-benzothiophen-4-ylideneamino]oxy-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol Traditional Name: 1-[(E)-6,7-dihydro-5H-benzothiophen-4-ylideneamino]oxy-3-(homoveratrylamino)propan-2-ol Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(CON=C2CCCC3=C2C=CS3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(CO/N=C/2\CCCC3=C2C=CS3)O)OC

InChI

InChI=1S/C21H28N2O4S/c1-25-19-7-6-15(12-20(19)26-2)8-10-22-13-16(24)14-27-23-18-4-3-5-21-17(18)9-11-28-21/h6-7,9,11-12,16,22,24H,3-5,8,10,13-14H2,1-2H3/b23-18+