methyl (2S)-3-(7-chloranyl-1-methyl-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(7-chloranyl-1-methyl-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(7-chloro-1-methyl-indol-3-yl)propanoate CAS Name: (2S)-3-(7-chloro-1-methyl-3-indolyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(7-chloro-1-methylindol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(7-chloro-1-methyl-indol-3-yl)propionic acid methyl ester Formula: C18H23ClN2O4 MolecularWeight: 366.83922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CN(C2=C1C=CC=C2Cl)C)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CN(C2=C1C=CC=C2Cl)C)C(=O)OC

InChI

InChI=1S/C18H23ClN2O4/c1-18(2,3)25-17(23)20-14(16(22)24-5)9-11-10-21(4)15-12(11)7-6-8-13(15)19/h6-8,10,14H,9H2,1-5H3,(H,20,23)/t14-/m0/s1