N-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[2-[(3-cyano-6-ethoxy-2-quinolin-1-iumyl)amino]ethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[2-[(3-cyano-6-ethoxyquinolin-1-ium-2-yl)amino]ethyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3,4,5-trimethoxy-benzamide Formula: C24H27N4O5+ MolecularWeight: 451.49498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCNC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCNC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C24H26N4O5/c1-5-33-18-6-7-19-15(11-18)10-17(14-25)23(28-19)26-8-9-27-24(29)16-12-20(30-2)22(32-4)21(13-16)31-3/h6-7,10-13H,5,8-9H2,1-4H3,(H,26,28)(H,27,29)/p+1