methyl 2-(3-naphthalen-2-ylsulfonylpropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(3-naphthalen-2-ylsulfonylpropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[3-(2-naphthylsulfonyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[3-(2-naphthalenylsulfonyl)-1-oxopropyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-naphthalen-2-ylsulfonylpropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-[3-(2-naphthylsulfonyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)CCS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1CC2=CC=CC=C2CN1C(=O)CCS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H23NO5S/c1-30-24(27)22-15-19-8-4-5-9-20(19)16-25(22)23(26)12-13-31(28,29)21-11-10-17-6-2-3-7-18(17)14-21/h2-11,14,22H,12-13,15-16H2,1H3