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3-[[4-[(2-acetamido-6-azanyl-hexanoyl)amino]phenyl]carbonylamino]-4-azanyl-4-oxidanylidene-butanoic acid

3-[[4-[(2-acetamido-6-azanyl-hexanoyl)amino]phenyl]carbonylamino]-4-azanyl-4-oxidanylidene-butanoic acid

Systemtic Name:3-[[4-[(2-acetamido-6-azanyl-hexanoyl)amino]phenyl]carbonylamino]-4-azanyl-4-oxidanylidene-butanoic acid
Openeye Name:3-[[4-[(2-acetamido-6-amino-hexanoyl)amino]benzoyl]amino]-4-amino-4-oxo-butanoic acid
CAS Name:3-[[[4-[(2-acetamido-6-amino-1-oxohexyl)amino]phenyl]-oxomethyl]amino]-4-amino-4-oxobutanoic acid
IUPAC Name:3-[[4-[(2-acetamido-6-aminohexanoyl)amino]benzoyl]amino]-4-amino-4-oxobutanoic acid
Traditional Name:3-[[4-[(2-acetamido-6-amino-hexanoyl)amino]benzoyl]amino]-4-amino-4-keto-butyric acid
Formula: C19H27N5O6
MolecularWeight: 421.44758
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN)C(=O)NC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C(=O)N


Isomeric SMILES

CC(=O)NC(CCCCN)C(=O)NC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C(=O)N


InChI

InChI=1S/C19H27N5O6/c1-11(25)22-14(4-2-3-9-20)19(30)23-13-7-5-12(6-8-13)18(29)24-15(17(21)28)10-16(26)27/h5-8,14-15H,2-4,9-10,20H2,1H3,(H2,21,28)(H,22,25)(H,23,30)(H,24,29)(H,26,27)


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