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

Systemtic Name: (2S)-6-(2-azanylethanoylamino)-2-[(4-butylphenyl)carbonylamino]hexanoic acid Openeye Name: (2S)-6-[(2-aminoacetyl)amino]-2-[(4-butylbenzoyl)amino]hexanoic acid CAS Name: (2S)-6-[(2-amino-1-oxoethyl)amino]-2-[[(4-butylphenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: (2S)-6-[(2-aminoacetyl)amino]-2-[(4-butylbenzoyl)amino]hexanoic acid Traditional Name: (2S)-2-[(4-butylbenzoyl)amino]-6-(glycylamino)hexanoic acid Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(CCCCNC(=O)CN)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N[C@@H](CCCCNC(=O)CN)C(=O)O

InChI

InChI=1S/C19H29N3O4/c1-2-3-6-14-8-10-15(11-9-14)18(24)22-16(19(25)26)7-4-5-12-21-17(23)13-20/h8-11,16H,2-7,12-13,20H2,1H3,(H,21,23)(H,22,24)(H,25,26)/t16-/m0/s1