methyl (2S)-3-(1H-indol-3-yl)-2-methyl-2-[[(1S,2S)-2-methylcyclohexyl]oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-methyl-2-[[(1S,2S)-2-methylcyclohexyl]oxycarbonylamino]propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-methyl-2-[[(1S,2S)-2-methylcyclohexoxy]carbonylamino]propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-methyl-2-[[[(1S,2S)-2-methylcyclohexyl]oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-methyl-2-[[(1S,2S)-2-methylcyclohexyl]oxycarbonylamino]propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-methyl-2-[[(1S,2S)-2-methylcyclohexoxy]carbonylamino]propionic acid methyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OC(=O)NC(C)(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

C[C@H]1CCCC[C@@H]1OC(=O)N[C@@](C)(CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H28N2O4/c1-14-8-4-7-11-18(14)27-20(25)23-21(2,19(24)26-3)12-15-13-22-17-10-6-5-9-16(15)17/h5-6,9-10,13-14,18,22H,4,7-8,11-12H2,1-3H3,(H,23,25)/t14-,18-,21-/m0/s1