methyl (2R,3S)-2-[2-(5-chloranylquinolin-8-yl)oxyethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[2-(5-chloranylquinolin-8-yl)oxyethanoylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[[2-[(5-chloro-8-quinolyl)oxy]acetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-[(5-chloro-8-quinolinyl)oxy]-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-[(5-chloro-8-quinolyl)oxy]acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC1=C2C(=C(C=C1)Cl)C=CC=N2

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)COC1=C2C(=C(C=C1)Cl)C=CC=N2

InChI

InChI=1S/C18H21ClN2O4/c1-4-11(2)16(18(23)24-3)21-15(22)10-25-14-8-7-13(19)12-6-5-9-20-17(12)14/h5-9,11,16H,4,10H2,1-3H3,(H,21,22)/t11-,16+/m0/s1