(2S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-4-methyl-pentanoate

Systemtic Name: (2S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-4-methyl-pentanoate Openeye Name: (2S)-2-(indane-5-carbonylamino)-4-methyl-pentanoate CAS Name: (2S)-2-[[2,3-dihydro-1H-inden-5-yl(oxo)methyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-(2,3-dihydro-1H-indene-5-carbonylamino)-4-methylpentanoate Traditional Name: (2S)-2-(indane-5-carbonylamino)-4-methyl-valerate Formula: C16H20NO3- MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-10(2)8-14(16(19)20)17-15(18)13-7-6-11-4-3-5-12(11)9-13/h6-7,9-10,14H,3-5,8H2,1-2H3,(H,17,18)(H,19,20)/p-1/t14-/m0/s1