N-(2-oxidanyl-3-phenoxy-propyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-oxidanyl-3-phenoxy-propyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-hydroxy-3-phenoxy-propyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-(2-hydroxy-3-phenoxypropyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-hydroxy-3-phenoxypropyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-hydroxy-3-phenoxy-propyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NCC(COC3=CC=CC=C3)O

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NCC(COC3=CC=CC=C3)O

InChI

InChI=1S/C18H21NO3S/c20-14(12-22-15-7-2-1-3-8-15)11-19-18(21)17-10-13-6-4-5-9-16(13)23-17/h1-3,7-8,10,14,20H,4-6,9,11-12H2,(H,19,21)