methyl 4-[[(2R)-2-naphthalen-2-yl-1-oxidanyl-but-3-yn-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[(2R)-2-naphthalen-2-yl-1-oxidanyl-but-3-yn-2-yl]amino]benzoate Openeye Name: methyl 4-[[(1R)-1-(hydroxymethyl)-1-(2-naphthyl)prop-2-ynyl]amino]benzoate CAS Name: 4-[[(2R)-1-hydroxy-2-(2-naphthalenyl)but-3-yn-2-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R)-1-hydroxy-2-naphthalen-2-ylbut-3-yn-2-yl]amino]benzoate Traditional Name: 4-[[(1R)-1-methylol-1-(2-naphthyl)prop-2-ynyl]amino]benzoic acid methyl ester Formula: C22H19NO3 MolecularWeight: 345.39116

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(CO)(C#C)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N[C@](CO)(C#C)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H19NO3/c1-3-22(15-24,19-11-8-16-6-4-5-7-18(16)14-19)23-20-12-9-17(10-13-20)21(25)26-2/h1,4-14,23-24H,15H2,2H3/t22-/m0/s1