methyl 5-methoxy-9-(phenylmethyl)-4,5-dihydro-3H-thiopyrano[3,4-b]indole-4-carboxylate

Systemtic Name: methyl 5-methoxy-9-(phenylmethyl)-4,5-dihydro-3H-thiopyrano[3,4-b]indole-4-carboxylate Openeye Name: methyl 9-benzyl-5-methoxy-4,5-dihydro-3H-thiopyrano[3,4-b]indole-4-carboxylate CAS Name: 5-methoxy-9-(phenylmethyl)-4,5-dihydro-3H-thiopyrano[3,4-b]indole-4-carboxylic acid methyl ester IUPAC Name: methyl 9-benzyl-5-methoxy-4,5-dihydro-3H-thiopyrano[3,4-b]indole-4-carboxylate Traditional Name: 9-benzyl-5-methoxy-4,5-dihydro-3H-thiopyran[3,4-b]indole-4-carboxylic acid methyl ester Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

COC1C=CC=C2C1=C3C(CSC=C3N2CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC1C=CC=C2C1=C3C(CSC=C3N2CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C21H21NO3S/c1-24-18-10-6-9-16-20(18)19-15(21(23)25-2)12-26-13-17(19)22(16)11-14-7-4-3-5-8-14/h3-10,13,15,18H,11-12H2,1-2H3