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

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-(indan-5-ylamino)-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-(indan-5-ylamino)-2-keto-ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4/c1-14(22-20(25)16-6-3-2-4-7-16)21(26)27-13-19(24)23-18-11-10-15-8-5-9-17(15)12-18/h2-4,6-7,10-12,14H,5,8-9,13H2,1H3,(H,22,25)(H,23,24)/t14-/m0/s1