3-[(3R)-1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[(3R)-1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[(3R)-1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(3R)-1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[(3R)-1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(3R)-1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidino-propan-1-one Formula: C18H30ClN4O+ MolecularWeight: 353.91

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH+]2CCCC(C2)CCC(=O)N3CCCC3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C[NH+]2CCC[C@@H](C2)CCC(=O)N3CCCC3)Cl)C

InChI

InChI=1S/C18H29ClN4O/c1-14-16(18(19)21(2)20-14)13-22-9-5-6-15(12-22)7-8-17(24)23-10-3-4-11-23/h15H,3-13H2,1-2H3/p+1/t15-/m1/s1