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

Systemtic Name: methyl 2-[4-[(2-chloranylphenoxy)methyl]thiophen-2-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[4-[(2-chlorophenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[[4-[(2-chlorophenoxy)methyl]-2-thiophenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-[(2-chlorophenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-[4-[(2-chlorophenoxy)methyl]thiophene-2-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C23H20ClNO4S MolecularWeight: 441.9272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC(=CS3)COC4=CC=CC=C4Cl

Isomeric SMILES

COC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC(=CS3)COC4=CC=CC=C4Cl

InChI

InChI=1S/C23H20ClNO4S/c1-28-23(27)19-11-16-6-2-3-7-17(16)12-25(19)22(26)21-10-15(14-30-21)13-29-20-9-5-4-8-18(20)24/h2-10,14,19H,11-13H2,1H3