2-[2-[4-[2-oxidanylidene-2-[(phenylmethyl)-propyl-amino]ethoxy]phenyl]ethoxy]benzoic acid

Systemtic Name: 2-[2-[4-[2-oxidanylidene-2-[(phenylmethyl)-propyl-amino]ethoxy]phenyl]ethoxy]benzoic acid Openeye Name: 2-[2-[4-[2-[benzyl(propyl)amino]-2-oxo-ethoxy]phenyl]ethoxy]benzoic acid CAS Name: 2-[2-[4-[2-oxo-2-[(phenylmethyl)-propylamino]ethoxy]phenyl]ethoxy]benzoic acid IUPAC Name: 2-[2-[4-[2-[benzyl(propyl)amino]-2-oxoethoxy]phenyl]ethoxy]benzoic acid Traditional Name: 2-[2-[4-[2-[benzyl(propyl)amino]-2-keto-ethoxy]phenyl]ethoxy]benzoic acid Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)COC2=CC=C(C=C2)CCOC3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)COC2=CC=C(C=C2)CCOC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C27H29NO5/c1-2-17-28(19-22-8-4-3-5-9-22)26(29)20-33-23-14-12-21(13-15-23)16-18-32-25-11-7-6-10-24(25)27(30)31/h3-15H,2,16-20H2,1H3,(H,30,31)