methyl 2-[4-(2,3-dihydro-1H-inden-5-yloxymethyl)thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-[4-(2,3-dihydro-1H-inden-5-yloxymethyl)thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[4-(indan-5-yloxymethyl)thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[[4-(2,3-dihydro-1H-inden-5-yloxymethyl)-2-thiophenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-(2,3-dihydro-1H-inden-5-yloxymethyl)thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-[4-(indan-5-yloxymethyl)thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC(=CS3)COC4=CC5=C(CCC5)C=C4

Isomeric SMILES

COC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC(=CS3)COC4=CC5=C(CCC5)C=C4

InChI

InChI=1S/C26H25NO4S/c1-30-26(29)23-13-20-5-2-3-6-21(20)14-27(23)25(28)24-11-17(16-32-24)15-31-22-10-9-18-7-4-8-19(18)12-22/h2-3,5-6,9-12,16,23H,4,7-8,13-15H2,1H3