methyl 2-[2-(cyclohexylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[2-(cyclohexylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[2-(cyclohexylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[2-[(cyclohexylamino)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(cyclohexylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[2-(cyclohexylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C2=CC=CC=C2CCN1C(=O)NC3CCCCC3

Isomeric SMILES

COC(=O)CC1C2=CC=CC=C2CCN1C(=O)NC3CCCCC3

InChI

InChI=1S/C19H26N2O3/c1-24-18(22)13-17-16-10-6-5-7-14(16)11-12-21(17)19(23)20-15-8-3-2-4-9-15/h5-7,10,15,17H,2-4,8-9,11-13H2,1H3,(H,20,23)