[4-[3-(carboxymethyl)-2,2-dimethyl-cyclobutyl]-1,3-thiazol-2-yl]-phenyl-azanium

Systemtic Name: [4-[3-(carboxymethyl)-2,2-dimethyl-cyclobutyl]-1,3-thiazol-2-yl]-phenyl-azanium Openeye Name: [4-[3-(carboxymethyl)-2,2-dimethyl-cyclobutyl]thiazol-2-yl]-phenyl-ammonium CAS Name: [4-[3-(carboxymethyl)-2,2-dimethylcyclobutyl]-2-thiazolyl]-phenylammonium IUPAC Name: [4-[3-(carboxymethyl)-2,2-dimethylcyclobutyl]-1,3-thiazol-2-yl]-phenylazanium Traditional Name: [4-[3-(carboxymethyl)-2,2-dimethyl-cyclobutyl]thiazol-2-yl]-phenyl-ammonium Formula: C17H21N2O2S+ MolecularWeight: 317.42584

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC1C2=CSC(=N2)[NH2+]C3=CC=CC=C3)CC(=O)O)C

Isomeric SMILES

CC1(C(CC1C2=CSC(=N2)[NH2+]C3=CC=CC=C3)CC(=O)O)C

InChI

InChI=1S/C17H20N2O2S/c1-17(2)11(9-15(20)21)8-13(17)14-10-22-16(19-14)18-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3,(H,18,19)(H,20,21)/p+1