[4-[(2R)-3-[ethanoyl(propan-2-yl)amino]-2-oxidanyl-propoxy]phenyl] benzoate

Systemtic Name: [4-[(2R)-3-[ethanoyl(propan-2-yl)amino]-2-oxidanyl-propoxy]phenyl] benzoate Openeye Name: [4-[(2R)-3-[acetyl(isopropyl)amino]-2-hydroxy-propoxy]phenyl] benzoate CAS Name: benzoic acid [4-[(2R)-3-[acetyl(propan-2-yl)amino]-2-hydroxypropoxy]phenyl] ester IUPAC Name: [4-[(2R)-3-[acetyl(propan-2-yl)amino]-2-hydroxypropoxy]phenyl] benzoate Traditional Name: benzoic acid [4-[(2R)-3-[acetyl(isopropyl)amino]-2-hydroxy-propoxy]phenyl] ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(COC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)O)C(=O)C

Isomeric SMILES

CC(C)N(C[C@H](COC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)O)C(=O)C

InChI

InChI=1S/C21H25NO5/c1-15(2)22(16(3)23)13-18(24)14-26-19-9-11-20(12-10-19)27-21(25)17-7-5-4-6-8-17/h4-12,15,18,24H,13-14H2,1-3H3/t18-/m1/s1