3-[[(3S)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-2-methyl-5-oxidanylidene-pyrazolidin-1-yl]methyl]pyridin-1-ium-1-carboxamide

Systemtic Name: 3-[[(3S)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-2-methyl-5-oxidanylidene-pyrazolidin-1-yl]methyl]pyridin-1-ium-1-carboxamide Openeye Name: 3-[[(3S)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-methyl-5-oxo-pyrazolidin-1-yl]methyl]pyridin-1-ium-1-carboxamide CAS Name: 3-[[(3S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-2-methyl-5-oxo-1-pyrazolidinyl]methyl]-1-pyridin-1-iumcarboxamide IUPAC Name: 3-[[(3S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-2-methyl-5-oxopyrazolidin-1-yl]methyl]pyridin-1-ium-1-carboxamide Traditional Name: 3-[[(3S)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-keto-2-methyl-pyrazolidin-1-yl]methyl]pyridin-1-ium-1-carboxamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(=O)N1CC2=C[N+](=CC=C2)C(=O)N)C3=CC(=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

CN1[C@@H](CC(=O)N1CC2=C[N+](=CC=C2)C(=O)N)C3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C23H28N4O4/c1-25-19(13-22(28)27(25)15-16-6-5-11-26(14-16)23(24)29)17-9-10-20(30-2)21(12-17)31-18-7-3-4-8-18/h5-6,9-12,14,18-19H,3-4,7-8,13,15H2,1-2H3,(H-,24,29)/p+1/t19-/m0/s1