O3-ethyl O6-methyl 4-[[(2S)-2-oxidanylpropyl]amino]quinoline-3,6-dicarboxylate

Systemtic Name: O3-ethyl O6-methyl 4-[[(2S)-2-oxidanylpropyl]amino]quinoline-3,6-dicarboxylate Openeye Name: O3-ethyl O6-methyl 4-[[(2S)-2-hydroxypropyl]amino]quinoline-3,6-dicarboxylate CAS Name: 4-[[(2S)-2-hydroxypropyl]amino]quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-methyl ester IUPAC Name: 3-O-ethyl 6-O-methyl 4-[[(2S)-2-hydroxypropyl]amino]quinoline-3,6-dicarboxylate Traditional Name: 4-[[(2S)-2-hydroxypropyl]amino]quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-methyl ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC(C)O)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC[C@H](C)O)C(=O)OC

InChI

InChI=1S/C17H20N2O5/c1-4-24-17(22)13-9-18-14-6-5-11(16(21)23-3)7-12(14)15(13)19-8-10(2)20/h5-7,9-10,20H,4,8H2,1-3H3,(H,18,19)/t10-/m0/s1