4-[[4-(2-methoxypropan-2-yl)phenyl]methylamino]benzoic acid

Systemtic Name: 4-[[4-(2-methoxypropan-2-yl)phenyl]methylamino]benzoic acid Openeye Name: 4-[[4-(1-methoxy-1-methyl-ethyl)phenyl]methylamino]benzoic acid CAS Name: 4-[[4-(2-methoxypropan-2-yl)phenyl]methylamino]benzoic acid IUPAC Name: 4-[[4-(2-methoxypropan-2-yl)phenyl]methylamino]benzoic acid Traditional Name: 4-[[4-(1-methoxy-1-methyl-ethyl)benzyl]amino]benzoic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)CNC2=CC=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)CNC2=CC=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C18H21NO3/c1-18(2,22-3)15-8-4-13(5-9-15)12-19-16-10-6-14(7-11-16)17(20)21/h4-11,19H,12H2,1-3H3,(H,20,21)