[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-(indan-5-ylamino)-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-(indan-5-ylamino)-2-keto-ethyl] ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NC1=CC2=C(CCC2)C=C1)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)NC1=CC2=C(CCC2)C=C1)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO3/c1-15(16-6-3-2-4-7-16)12-21(24)25-14-20(23)22-19-11-10-17-8-5-9-18(17)13-19/h2-4,6-7,10-11,13,15H,5,8-9,12,14H2,1H3,(H,22,23)/t15-/m1/s1