2-(3-cyclopentyl-2-ethylimino-4-oxidanylidene-1,3-thiazolidin-5-yl)ethanoate; (phenylmethyl)azanium

Systemtic Name: 2-(3-cyclopentyl-2-ethylimino-4-oxidanylidene-1,3-thiazolidin-5-yl)ethanoate; (phenylmethyl)azanium Openeye Name: benzylammonium; 2-(3-cyclopentyl-2-ethylimino-4-oxo-thiazolidin-5-yl)acetate CAS Name: 2-(3-cyclopentyl-2-ethylimino-4-oxo-5-thiazolidinyl)acetate; (phenylmethyl)ammonium IUPAC Name: benzylazanium; 2-(3-cyclopentyl-2-ethylimino-4-oxo-1,3-thiazolidin-5-yl)acetate Traditional Name: benzylammonium; 2-(3-cyclopentyl-2-ethylimino-4-keto-thiazolidin-5-yl)acetate Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1N(C(=O)C(S1)CC(=O)[O-])C2CCCC2.C1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CCN=C1N(C(=O)C(S1)CC(=O)[O-])C2CCCC2.C1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C12H18N2O3S.C7H9N/c1-2-13-12-14(8-5-3-4-6-8)11(17)9(18-12)7-10(15)16;8-6-7-4-2-1-3-5-7/h8-9H,2-7H2,1H3,(H,15,16);1-5H,6,8H2