(2R)-N-[3-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]propyl]oxolane-2-carboxamide

Systemtic Name: (2R)-N-[3-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]propyl]oxolane-2-carboxamide Openeye Name: (2R)-N-[3-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]propyl]tetrahydrofuran-2-carboxamide CAS Name: (2R)-N-[3-[(3-cyano-7-methyl-2-quinolin-1-iumyl)amino]propyl]-2-oxolanecarboxamide IUPAC Name: (2R)-N-[3-[(3-cyano-7-methylquinolin-1-ium-2-yl)amino]propyl]oxolane-2-carboxamide Traditional Name: (2R)-N-[3-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]propyl]tetrahydrofuran-2-carboxamide Formula: C19H23N4O2+ MolecularWeight: 339.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=[NH+]2)NCCCNC(=O)C3CCCO3)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=[NH+]2)NCCCNC(=O)[C@H]3CCCO3)C#N

InChI

InChI=1S/C19H22N4O2/c1-13-5-6-14-11-15(12-20)18(23-16(14)10-13)21-7-3-8-22-19(24)17-4-2-9-25-17/h5-6,10-11,17H,2-4,7-9H2,1H3,(H,21,23)(H,22,24)/p+1/t17-/m1/s1