(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-cyclopentyloxyimino-ethanoate; 1-methyl-1-prop-2-enyl-pyrrolidin-1-ium

Systemtic Name: (2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-cyclopentyloxyimino-ethanoate; 1-methyl-1-prop-2-enyl-pyrrolidin-1-ium Openeye Name: 1-allyl-1-methyl-pyrrolidin-1-ium; (2Z)-2-(2-aminothiazol-4-yl)-2-(cyclopentoxyimino)acetate CAS Name: (2Z)-2-(2-amino-4-thiazolyl)-2-cyclopentyloxyiminoacetate; 1-methyl-1-prop-2-enylpyrrolidin-1-ium IUPAC Name: (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-cyclopentyloxyiminoacetate; 1-methyl-1-prop-2-enylpyrrolidin-1-ium Traditional Name: 1-allyl-1-methyl-pyrrolidin-1-ium; (2Z)-2-(2-aminothiazol-4-yl)-2-cyclopentyloximino-acetate Formula: C18H28N4O3S MolecularWeight: 380.50492

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CC=C.C1CCC(C1)ON=C(C2=CSC(=N2)N)C(=O)[O-]

Isomeric SMILES

C[N+]1(CCCC1)CC=C.C1CCC(C1)O/N=C(/C2=CSC(=N2)N)\C(=O)[O-]

InChI

InChI=1S/C10H13N3O3S.C8H16N/c11-10-12-7(5-17-10)8(9(14)15)13-16-6-3-1-2-4-6;1-3-6-9(2)7-4-5-8-9/h5-6H,1-4H2,(H2,11,12)(H,14,15);3H,1,4-8H2,2H3/q;+1/p-1/b13-8-;