(2S)-2-azanyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indol-3-yl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indol-3-yl]propanoic acid Openeye Name: (2S)-2-amino-3-[4-(tert-butoxycarbonylamino)-1H-indol-3-yl]propanoic acid CAS Name: (2S)-2-amino-3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1H-indol-3-yl]propanoic acid IUPAC Name: (2S)-2-amino-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indol-3-yl]propanoic acid Traditional Name: (2S)-2-amino-3-[4-(tert-butoxycarbonylamino)-1H-indol-3-yl]propionic acid Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC2=C1C(=CN2)CC(C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC2=C1C(=CN2)C[C@@H](C(=O)O)N

InChI

InChI=1S/C16H21N3O4/c1-16(2,3)23-15(22)19-12-6-4-5-11-13(12)9(8-18-11)7-10(17)14(20)21/h4-6,8,10,18H,7,17H2,1-3H3,(H,19,22)(H,20,21)/t10-/m0/s1