3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3-phenylazanyl-propanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3-phenylazanyl-propanoic acid Openeye Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-propanoic acid CAS Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2,2-dimethylpropanoic acid IUPAC Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2,2-dimethylpropanoic acid Traditional Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-propionic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC2=C(C=C1)OCO2)NC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C(C1=CC2=C(C=C1)OCO2)NC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19NO4/c1-18(2,17(20)21)16(19-13-6-4-3-5-7-13)12-8-9-14-15(10-12)23-11-22-14/h3-10,16,19H,11H2,1-2H3,(H,20,21)