methyl 2-[4-[(2,4,6-trimethylphenoxy)methyl]thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-[4-[(2,4,6-trimethylphenoxy)methyl]thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[oxo-[4-[(2,4,6-trimethylphenoxy)methyl]-2-thiophenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-[4-[(2,4,6-trimethylphenoxy)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:

CC1=CC(=C(C(=C1)C)OCC2=CSC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC2=CSC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)OC)C

InChI

InChI=1S/C26H27NO4S/c1-16-9-17(2)24(18(3)10-16)31-14-19-11-23(32-15-19)25(28)27-13-21-8-6-5-7-20(21)12-22(27)26(29)30-4/h5-11,15,22H,12-14H2,1-4H3