N-[[2-(dimethylamino)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[[2-(dimethylamino)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-4-pyrazol-1-yl-benzamide Openeye Name: N-[[2-(dimethylamino)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-4-pyrazol-1-yl-benzamide CAS Name: N-[[2-(dimethylamino)-7-methoxy-3-quinolin-1-iumyl]methyl]-N-(2-methoxyethyl)-4-(1-pyrazolyl)benzamide IUPAC Name: N-[[2-(dimethylamino)-7-methoxyquinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-4-pyrazol-1-ylbenzamide Traditional Name: N-[[2-(dimethylamino)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-4-pyrazol-1-yl-benzamide Formula: C26H30N5O3+ MolecularWeight: 460.5481

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C2C=CC(=CC2=[NH+]1)OC)CN(CCOC)C(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CN(C)C1=C(C=C2C=CC(=CC2=[NH+]1)OC)CN(CCOC)C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C26H29N5O3/c1-29(2)25-21(16-20-8-11-23(34-4)17-24(20)28-25)18-30(14-15-33-3)26(32)19-6-9-22(10-7-19)31-13-5-12-27-31/h5-13,16-17H,14-15,18H2,1-4H3/p+1