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

Systemtic Name: 4-[bis(2-oxidanylpropyl)amino]-2-ethyl-benzoic acid Openeye Name: 4-[bis(2-hydroxypropyl)amino]-2-ethyl-benzoic acid CAS Name: 4-[bis(2-hydroxypropyl)amino]-2-ethylbenzoic acid IUPAC Name: 4-[bis(2-hydroxypropyl)amino]-2-ethylbenzoic acid Traditional Name: 4-[bis(2-hydroxypropyl)amino]-2-ethyl-benzoic acid Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)N(CC(C)O)CC(C)O)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)N(CC(C)O)CC(C)O)C(=O)O

InChI

InChI=1S/C15H23NO4/c1-4-12-7-13(5-6-14(12)15(19)20)16(8-10(2)17)9-11(3)18/h5-7,10-11,17-18H,4,8-9H2,1-3H3,(H,19,20)