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

Systemtic Name: methyl (2S)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(indane-5-carbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[2,3-dihydro-1H-inden-5-yl(oxo)methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(2,3-dihydro-1H-indene-5-carbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(indane-5-carbonylamino)-3-phenyl-propionic acid methyl ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C20H21NO3/c1-24-20(23)18(12-14-6-3-2-4-7-14)21-19(22)17-11-10-15-8-5-9-16(15)13-17/h2-4,6-7,10-11,13,18H,5,8-9,12H2,1H3,(H,21,22)/t18-/m0/s1