[2-(2-chlorophenyl)-4-ethoxycarbonyl-pyrazol-3-yl]methyl-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]azanium

Systemtic Name: [2-(2-chlorophenyl)-4-ethoxycarbonyl-pyrazol-3-yl]methyl-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]azanium Openeye Name: [2-(2-chlorophenyl)-4-ethoxycarbonyl-pyrazol-3-yl]methyl-[3-(2-oxopyrrolidin-1-yl)propyl]ammonium CAS Name: [2-(2-chlorophenyl)-4-ethoxycarbonyl-3-pyrazolyl]methyl-[3-(2-oxo-1-pyrrolidinyl)propyl]ammonium IUPAC Name: [2-(2-chlorophenyl)-4-ethoxycarbonylpyrazol-3-yl]methyl-[3-(2-oxopyrrolidin-1-yl)propyl]azanium Traditional Name: [4-carbethoxy-2-(2-chlorophenyl)pyrazol-3-yl]methyl-[3-(2-ketopyrrolidino)propyl]ammonium Formula: C20H26ClN4O3+ MolecularWeight: 405.89844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2Cl)C[NH2+]CCCN3CCCC3=O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2Cl)C[NH2+]CCCN3CCCC3=O

InChI

InChI=1S/C20H25ClN4O3/c1-2-28-20(27)15-13-23-25(17-8-4-3-7-16(17)21)18(15)14-22-10-6-12-24-11-5-9-19(24)26/h3-4,7-8,13,22H,2,5-6,9-12,14H2,1H3/p+1