5,7-dimethyl-3-[(3-oxidanylpropylamino)methyl]-3H-quinolin-2-one; ethanedioic acid

Systemtic Name: 5,7-dimethyl-3-[(3-oxidanylpropylamino)methyl]-3H-quinolin-2-one; ethanedioic acid Openeye Name: 3-[(3-hydroxypropylamino)methyl]-5,7-dimethyl-3H-quinolin-2-one; oxalic acid CAS Name: 3-[(3-hydroxypropylamino)methyl]-5,7-dimethyl-3H-quinolin-2-one; oxalic acid IUPAC Name: 3-[(3-hydroxypropylamino)methyl]-5,7-dimethyl-3H-quinolin-2-one; oxalic acid Traditional Name: 3-[(3-hydroxypropylamino)methyl]-5,7-dimethyl-3H-quinolin-2-one; oxalic acid Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=O)C(C=C2C(=C1)C)CNCCCO.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=NC(=O)C(C=C2C(=C1)C)CNCCCO.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H20N2O2.C2H2O4/c1-10-6-11(2)13-8-12(9-16-4-3-5-18)15(19)17-14(13)7-10;3-1(4)2(5)6/h6-8,12,16,18H,3-5,9H2,1-2H3;(H,3,4)(H,5,6)