4-[bis(2-oxidanylpropyl)amino]benzoic acid

Systemtic Name: 4-[bis(2-oxidanylpropyl)amino]benzoic acid Openeye Name: 4-[bis(2-hydroxypropyl)amino]benzoic acid CAS Name: 4-[bis(2-hydroxypropyl)amino]benzoic acid IUPAC Name: 4-[bis(2-hydroxypropyl)amino]benzoic acid Traditional Name: 4-[bis(2-hydroxypropyl)amino]benzoic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(C)O)C1=CC=C(C=C1)C(=O)O)O

Isomeric SMILES

CC(CN(CC(C)O)C1=CC=C(C=C1)C(=O)O)O

InChI

InChI=1S/C13H19NO4/c1-9(15)7-14(8-10(2)16)12-5-3-11(4-6-12)13(17)18/h3-6,9-10,15-16H,7-8H2,1-2H3,(H,17,18)