ethanoyl 6-azanyl-2-[[2-(2-azanylethanoylamino)-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate

Systemtic Name: ethanoyl 6-azanyl-2-[[2-(2-azanylethanoylamino)-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate Openeye Name: acetyl 6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate CAS Name: 6-amino-2-[[2-[(2-amino-1-oxoethyl)amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]hexanoic acid acetyl ester IUPAC Name: acetyl 6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate Traditional Name: 6-amino-2-[[2-(glycylamino)-3-(4-hydroxyphenyl)propanoyl]amino]hexanoic acid acetyl ester Formula: C19H28N4O6 MolecularWeight: 408.44882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(=O)C(CCCCN)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)CN

Isomeric SMILES

CC(=O)OC(=O)C(CCCCN)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)CN

InChI

InChI=1S/C19H28N4O6/c1-12(24)29-19(28)15(4-2-3-9-20)23-18(27)16(22-17(26)11-21)10-13-5-7-14(25)8-6-13/h5-8,15-16,25H,2-4,9-11,20-21H2,1H3,(H,22,26)(H,23,27)