2-[3-[[1-(cyclopropylmethyl)pyrrolidin-1-ium-1-yl]methylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[[1-(cyclopropylmethyl)pyrrolidin-1-ium-1-yl]methylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]ethanoic acid Openeye Name: 2-[3-[[1-(cyclopropylmethyl)pyrrolidin-1-ium-1-yl]methylamino]-6-methyl-2-oxo-pyrazin-1-yl]acetic acid CAS Name: 2-[3-[[1-(cyclopropylmethyl)-1-pyrrolidin-1-iumyl]methylamino]-6-methyl-2-oxo-1-pyrazinyl]acetic acid IUPAC Name: 2-[3-[[1-(cyclopropylmethyl)pyrrolidin-1-ium-1-yl]methylamino]-6-methyl-2-oxopyrazin-1-yl]acetic acid Traditional Name: 2-[3-[[1-(cyclopropylmethyl)pyrrolidin-1-ium-1-yl]methylamino]-2-keto-6-methyl-pyrazin-1-yl]acetic acid Formula: C16H25N4O3+ MolecularWeight: 321.3947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)O)NC[N+]2(CCCC2)CC3CC3

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)O)NC[N+]2(CCCC2)CC3CC3

InChI

InChI=1S/C16H24N4O3/c1-12-8-17-15(16(23)19(12)9-14(21)22)18-11-20(6-2-3-7-20)10-13-4-5-13/h8,13H,2-7,9-11H2,1H3,(H-,17,18,21,22)/p+1