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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-phenyl-3-phenylazanyl-propanoic acid Openeye Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2-phenyl-propanoic acid CAS Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2-phenylpropanoic acid IUPAC Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2-phenylpropanoic acid Traditional Name: 3-anilino-3-(1,3-benzodioxol-5-yl)-2-phenyl-propionic acid Formula: C22H19NO4 MolecularWeight: 361.39056

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C(C3=CC=CC=C3)C(=O)O)NC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C(C3=CC=CC=C3)C(=O)O)NC4=CC=CC=C4

InChI

InChI=1S/C22H19NO4/c24-22(25)20(15-7-3-1-4-8-15)21(23-17-9-5-2-6-10-17)16-11-12-18-19(13-16)27-14-26-18/h1-13,20-21,23H,14H2,(H,24,25)