ethyl 4-[(2R)-3-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethyl 4-[(2R)-3-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 4-[(2R)-3-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-hydroxy-propoxy]benzoate CAS Name: 4-[(2R)-3-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-hydroxypropoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-3-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-hydroxypropoxy]benzoate Traditional Name: 4-[(2R)-3-[cyclopropyl(p-anisyl)amino]-2-hydroxy-propoxy]benzoic acid ethyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CN(CC2=CC=C(C=C2)OC)C3CC3)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC[C@@H](CN(CC2=CC=C(C=C2)OC)C3CC3)O

InChI

InChI=1S/C23H29NO5/c1-3-28-23(26)18-6-12-22(13-7-18)29-16-20(25)15-24(19-8-9-19)14-17-4-10-21(27-2)11-5-17/h4-7,10-13,19-20,25H,3,8-9,14-16H2,1-2H3/t20-/m1/s1