2-(phenylmethoxycarbonylamino)-3-[(3-propyl-1H-indol-2-yl)carbonylamino]propanoic acid

Systemtic Name: 2-(phenylmethoxycarbonylamino)-3-[(3-propyl-1H-indol-2-yl)carbonylamino]propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-[(3-propyl-1H-indole-2-carbonyl)amino]propanoic acid CAS Name: 3-[[oxo-(3-propyl-1H-indol-2-yl)methyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 2-(phenylmethoxycarbonylamino)-3-[(3-propyl-1H-indole-2-carbonyl)amino]propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-[(3-propyl-1H-indole-2-carbonyl)amino]propionic acid Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC2=CC=CC=C21)C(=O)NCC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(NC2=CC=CC=C21)C(=O)NCC(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O5/c1-2-8-17-16-11-6-7-12-18(16)25-20(17)21(27)24-13-19(22(28)29)26-23(30)31-14-15-9-4-3-5-10-15/h3-7,9-12,19,25H,2,8,13-14H2,1H3,(H,24,27)(H,26,30)(H,28,29)