1-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3-(3-methoxyphenyl)urea

Systemtic Name: 1-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3-(3-methoxyphenyl)urea CAS Name: 1-[2-[(3-cyano-6-ethoxy-2-quinolin-1-iumyl)amino]ethyl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[2-[(3-cyano-6-ethoxyquinolin-1-ium-2-yl)amino]ethyl]-3-(3-methoxyphenyl)urea Traditional Name: 1-[2-[(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)amino]ethyl]-3-(3-methoxyphenyl)urea Formula: C22H24N5O3+ MolecularWeight: 406.45766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCNC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCNC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H23N5O3/c1-3-30-19-7-8-20-15(12-19)11-16(14-23)21(27-20)24-9-10-25-22(28)26-17-5-4-6-18(13-17)29-2/h4-8,11-13H,3,9-10H2,1-2H3,(H,24,27)(H2,25,26,28)/p+1