3-[(3-methylphenyl)methyl-[(2,4,6-trimethylphenyl)methyl]amino]propanoic acid

Systemtic Name: 3-[(3-methylphenyl)methyl-[(2,4,6-trimethylphenyl)methyl]amino]propanoic acid Openeye Name: 3-[m-tolylmethyl-[(2,4,6-trimethylphenyl)methyl]amino]propanoic acid CAS Name: 3-[(3-methylphenyl)methyl-[(2,4,6-trimethylphenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(3-methylphenyl)methyl-[(2,4,6-trimethylphenyl)methyl]amino]propanoic acid Traditional Name: 3-[(3-methylbenzyl)-(2,4,6-trimethylbenzyl)amino]propionic acid Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN(CCC(=O)O)CC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN(CCC(=O)O)CC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C21H27NO2/c1-15-6-5-7-19(12-15)13-22(9-8-21(23)24)14-20-17(3)10-16(2)11-18(20)4/h5-7,10-12H,8-9,13-14H2,1-4H3,(H,23,24)