(phenylmethyl) 2-[3-chloranyl-5-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-2-methyl-6-oxidanylidene-pyrazin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-chloranyl-5-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-2-methyl-6-oxidanylidene-pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[3-chloro-5-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-2-methyl-6-oxo-pyrazin-1-yl]acetate CAS Name: 2-[3-chloro-5-[(1-cyclopentyl-1-pyrrolidin-1-iumyl)methylamino]-2-methyl-6-oxo-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-chloro-5-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-2-methyl-6-oxopyrazin-1-yl]acetate Traditional Name: 2-[5-chloro-3-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-2-keto-6-methyl-pyrazin-1-yl]acetic acid benzyl ester Formula: C24H32ClN4O3+ MolecularWeight: 459.98888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=O)N1CC(=O)OCC2=CC=CC=C2)NC[N+]3(CCCC3)C4CCCC4)Cl

Isomeric SMILES

CC1=C(N=C(C(=O)N1CC(=O)OCC2=CC=CC=C2)NC[N+]3(CCCC3)C4CCCC4)Cl

InChI

InChI=1S/C24H32ClN4O3/c1-18-22(25)27-23(26-17-29(13-7-8-14-29)20-11-5-6-12-20)24(31)28(18)15-21(30)32-16-19-9-3-2-4-10-19/h2-4,9-10,20H,5-8,11-17H2,1H3,(H,26,27)/q+1