4-[3-[1-azanyl-2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]phenyl]benzoic acid

Systemtic Name: 4-[3-[1-azanyl-2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]phenyl]benzoic acid Openeye Name: 4-[3-(1-amino-2-tert-butoxy-2-oxo-ethyl)phenyl]benzoic acid CAS Name: 4-[3-[1-amino-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]phenyl]benzoic acid IUPAC Name: 4-[3-[1-amino-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]phenyl]benzoic acid Traditional Name: 4-[3-(1-amino-2-tert-butoxy-2-keto-ethyl)phenyl]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-19(2,3)24-18(23)16(20)15-6-4-5-14(11-15)12-7-9-13(10-8-12)17(21)22/h4-11,16H,20H2,1-3H3,(H,21,22)