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

Systemtic Name: (2S)-6-(2-azanylethanoylamino)-2-[(4-butoxyphenyl)carbonylamino]hexanoic acid Openeye Name: (2S)-6-[(2-aminoacetyl)amino]-2-[(4-butoxybenzoyl)amino]hexanoic acid CAS Name: (2S)-6-[(2-amino-1-oxoethyl)amino]-2-[[(4-butoxyphenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: (2S)-6-[(2-aminoacetyl)amino]-2-[(4-butoxybenzoyl)amino]hexanoic acid Traditional Name: (2S)-2-[(4-butoxybenzoyl)amino]-6-(glycylamino)hexanoic acid Formula: C19H29N3O5 MolecularWeight: 379.45066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(CCCCNC(=O)CN)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N[C@@H](CCCCNC(=O)CN)C(=O)O

InChI

InChI=1S/C19H29N3O5/c1-2-3-12-27-15-9-7-14(8-10-15)18(24)22-16(19(25)26)6-4-5-11-21-17(23)13-20/h7-10,16H,2-6,11-13,20H2,1H3,(H,21,23)(H,22,24)(H,25,26)/t16-/m0/s1