2-[(3-propan-2-ylphenyl)amino]-3-(3,4,5-trimethoxyphenyl)propanoic acid

Systemtic Name: 2-[(3-propan-2-ylphenyl)amino]-3-(3,4,5-trimethoxyphenyl)propanoic acid Openeye Name: 2-(3-isopropylanilino)-3-(3,4,5-trimethoxyphenyl)propanoic acid CAS Name: 2-(3-propan-2-ylanilino)-3-(3,4,5-trimethoxyphenyl)propanoic acid IUPAC Name: 2-(3-propan-2-ylanilino)-3-(3,4,5-trimethoxyphenyl)propanoic acid Traditional Name: 2-(3-isopropylanilino)-3-(3,4,5-trimethoxyphenyl)propionic acid Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(CC2=CC(=C(C(=C2)OC)OC)OC)C(=O)O

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(CC2=CC(=C(C(=C2)OC)OC)OC)C(=O)O

InChI

InChI=1S/C21H27NO5/c1-13(2)15-7-6-8-16(12-15)22-17(21(23)24)9-14-10-18(25-3)20(27-5)19(11-14)26-4/h6-8,10-13,17,22H,9H2,1-5H3,(H,23,24)