N-[(7-chloranyl-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl]-N-(furan-2-ylmethyl)-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-[(7-chloranyl-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl]-N-(furan-2-ylmethyl)-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-[(7-chloro-2-pyrrolidin-1-yl-quinolin-1-ium-3-yl)methyl]-N-(2-furylmethyl)-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-[[7-chloro-2-(1-pyrrolidinyl)-3-quinolin-1-iumyl]methyl]-N-(2-furanylmethyl)-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[(7-chloro-2-pyrrolidin-1-ylquinolin-1-ium-3-yl)methyl]-N-(furan-2-ylmethyl)-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-[(7-chloro-2-pyrrolidino-quinolin-1-ium-3-yl)methyl]-N-(2-furfuryl)-3-(3-methylpyrazol-1-yl)propionamide Formula: C26H29ClN5O2+ MolecularWeight: 478.99376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CCC(=O)N(CC2=CC=CO2)CC3=C([NH+]=C4C=C(C=CC4=C3)Cl)N5CCCC5

Isomeric SMILES

CC1=NN(C=C1)CCC(=O)N(CC2=CC=CO2)CC3=C([NH+]=C4C=C(C=CC4=C3)Cl)N5CCCC5

InChI

InChI=1S/C26H28ClN5O2/c1-19-8-12-32(29-19)13-9-25(33)31(18-23-5-4-14-34-23)17-21-15-20-6-7-22(27)16-24(20)28-26(21)30-10-2-3-11-30/h4-8,12,14-16H,2-3,9-11,13,17-18H2,1H3/p+1