(2S,3S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-3-methyl-pentanoate Openeye Name: (2S,3S)-2-(indane-5-carbonylamino)-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[2,3-dihydro-1H-inden-5-yl(oxo)methyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-(2,3-dihydro-1H-indene-5-carbonylamino)-3-methylpentanoate Traditional Name: (2S,3S)-2-(indane-5-carbonylamino)-3-methyl-valerate Formula: C16H20NO3- MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C1=CC2=C(CCC2)C=C1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)C1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C16H21NO3/c1-3-10(2)14(16(19)20)17-15(18)13-8-7-11-5-4-6-12(11)9-13/h7-10,14H,3-6H2,1-2H3,(H,17,18)(H,19,20)/p-1/t10-,14-/m0/s1