(2S,3R)-2-(3,4-dihydro-2H-quinolin-1-ylcarbonylamino)-3-methyl-pentanoate

Systemtic Name: (2S,3R)-2-(3,4-dihydro-2H-quinolin-1-ylcarbonylamino)-3-methyl-pentanoate Openeye Name: (2S,3R)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3-methyl-pentanoate CAS Name: (2S,3R)-2-[[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]amino]-3-methylpentanoate IUPAC Name: (2S,3R)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3-methylpentanoate Traditional Name: (2S,3R)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3-methyl-valerate Formula: C16H21N2O3- MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)N1CCCC2=CC=CC=C21

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)[O-])NC(=O)N1CCCC2=CC=CC=C21

InChI

InChI=1S/C16H22N2O3/c1-3-11(2)14(15(19)20)17-16(21)18-10-6-8-12-7-4-5-9-13(12)18/h4-5,7,9,11,14H,3,6,8,10H2,1-2H3,(H,17,21)(H,19,20)/p-1/t11-,14+/m1/s1