(2S)-3-(3-carbamimidoylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: (2S)-3-(3-carbamimidoylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-(3-carbamimidoylphenyl)propanoic acid CAS Name: (2S)-3-(3-carbamimidoylphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(3-carbamimidoylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2S)-3-(3-amidinophenyl)-2-(tert-butoxycarbonylamino)propionic acid Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC(=C1)C(=N)N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC(=C1)C(=N)N)C(=O)O

InChI

InChI=1S/C15H21N3O4/c1-15(2,3)22-14(21)18-11(13(19)20)8-9-5-4-6-10(7-9)12(16)17/h4-7,11H,8H2,1-3H3,(H3,16,17)(H,18,21)(H,19,20)/t11-/m0/s1