5-nitroso-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-nitroso-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-nitroso-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-nitroso-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-nitroso-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-nitroso-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2CCN(C3=CC=CC=C3S2)N=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2CCN(C3=CC=CC=C3S2)N=O

InChI

InChI=1S/C18H20N2O4S/c1-22-14-10-12(11-15(23-2)18(14)24-3)16-8-9-20(19-21)13-6-4-5-7-17(13)25-16/h4-7,10-11,16H,8-9H2,1-3H3