methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonylamino)-3-methyl-pentanoate

Systemtic Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonylamino)-3-methyl-pentanoate Openeye Name: methyl 2-(3,4-dihydro-1H-isoquinoline-2-carbonylamino)-3-methyl-pentanoate CAS Name: 2-[[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-1H-isoquinoline-2-carbonylamino)-3-methylpentanoate Traditional Name: 2-(3,4-dihydro-1H-isoquinoline-2-carbonylamino)-3-methyl-valeric acid methyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C17H24N2O3/c1-4-12(2)15(16(20)22-3)18-17(21)19-10-9-13-7-5-6-8-14(13)11-19/h5-8,12,15H,4,9-11H2,1-3H3,(H,18,21)