2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]benzoate

Systemtic Name: 2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]benzoate Openeye Name: 2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]benzoate CAS Name: 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]benzoate IUPAC Name: 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]benzoate Traditional Name: 2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]benzoate Formula: C19H22NO4- MolecularWeight: 328.38228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)C2=CC=CC=C2C(=O)[O-])O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)C2=CC=CC=C2C(=O)[O-])O

InChI

InChI=1S/C19H23NO4/c1-13(2)20-11-15(21)12-24-16-9-7-14(8-10-16)17-5-3-4-6-18(17)19(22)23/h3-10,13,15,20-21H,11-12H2,1-2H3,(H,22,23)/p-1