(2S)-6-(2-azanylethanoylamino)-2-[(4-ethoxyphenyl)carbonylamino]hexanoic acid

Systemtic Name: (2S)-6-(2-azanylethanoylamino)-2-[(4-ethoxyphenyl)carbonylamino]hexanoic acid Openeye Name: (2S)-6-[(2-aminoacetyl)amino]-2-[(4-ethoxybenzoyl)amino]hexanoic acid CAS Name: (2S)-6-[(2-amino-1-oxoethyl)amino]-2-[[(4-ethoxyphenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: (2S)-6-[(2-aminoacetyl)amino]-2-[(4-ethoxybenzoyl)amino]hexanoic acid Traditional Name: (2S)-2-[(4-ethoxybenzoyl)amino]-6-(glycylamino)hexanoic acid Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(CCCCNC(=O)CN)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@@H](CCCCNC(=O)CN)C(=O)O

InChI

InChI=1S/C17H25N3O5/c1-2-25-13-8-6-12(7-9-13)16(22)20-14(17(23)24)5-3-4-10-19-15(21)11-18/h6-9,14H,2-5,10-11,18H2,1H3,(H,19,21)(H,20,22)(H,23,24)/t14-/m0/s1