N-[3-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]propyl]-2-methoxy-ethanamide

Systemtic Name: N-[3-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]propyl]-2-methoxy-ethanamide Openeye Name: N-[3-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]propyl]-2-methoxy-acetamide CAS Name: N-[3-[(3-cyano-6-ethoxy-2-quinolin-1-iumyl)amino]propyl]-2-methoxyacetamide IUPAC Name: N-[3-[(3-cyano-6-ethoxyquinolin-1-ium-2-yl)amino]propyl]-2-methoxyacetamide Traditional Name: N-[3-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]propyl]-2-methoxy-acetamide Formula: C18H23N4O3+ MolecularWeight: 343.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCCNC(=O)COC

Isomeric SMILES

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCCNC(=O)COC

InChI

InChI=1S/C18H22N4O3/c1-3-25-15-5-6-16-13(10-15)9-14(11-19)18(22-16)21-8-4-7-20-17(23)12-24-2/h5-6,9-10H,3-4,7-8,12H2,1-2H3,(H,20,23)(H,21,22)/p+1