N-[2-[(3-cyano-7,8-dimethyl-quinolin-1-ium-2-yl)amino]ethyl]cyclobutanecarboxamide

Systemtic Name: N-[2-[(3-cyano-7,8-dimethyl-quinolin-1-ium-2-yl)amino]ethyl]cyclobutanecarboxamide Openeye Name: N-[2-[(3-cyano-7,8-dimethyl-quinolin-1-ium-2-yl)amino]ethyl]cyclobutanecarboxamide CAS Name: N-[2-[(3-cyano-7,8-dimethyl-2-quinolin-1-iumyl)amino]ethyl]cyclobutanecarboxamide IUPAC Name: N-[2-[(3-cyano-7,8-dimethylquinolin-1-ium-2-yl)amino]ethyl]cyclobutanecarboxamide Traditional Name: N-[2-[(3-cyano-7,8-dimethyl-quinolin-1-ium-2-yl)amino]ethyl]cyclobutanecarboxamide Formula: C19H23N4O+ MolecularWeight: 323.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=[NH+]2)NCCNC(=O)C3CCC3)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=[NH+]2)NCCNC(=O)C3CCC3)C#N)C

InChI

InChI=1S/C19H22N4O/c1-12-6-7-15-10-16(11-20)18(23-17(15)13(12)2)21-8-9-22-19(24)14-4-3-5-14/h6-7,10,14H,3-5,8-9H2,1-2H3,(H,21,23)(H,22,24)/p+1