methyl 2-[4-[(4-propan-2-ylphenoxy)methyl]thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-[4-[(4-propan-2-ylphenoxy)methyl]thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[4-[(4-isopropylphenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[oxo-[4-[(4-propan-2-ylphenoxy)methyl]-2-thiophenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-[(4-propan-2-ylphenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-[4-[(4-isopropylphenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C26H27NO4S MolecularWeight: 449.56188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)OC

InChI

InChI=1S/C26H27NO4S/c1-17(2)19-8-10-22(11-9-19)31-15-18-12-24(32-16-18)25(28)27-14-21-7-5-4-6-20(21)13-23(27)26(29)30-3/h4-12,16-17,23H,13-15H2,1-3H3