6-azanyl-2-[[2-[[2-(butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-[[2-(butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[2-[[2-(butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[2-[[2-[[butoxy(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]-1-oxo-3-phenylpropyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[2-[[2-(butoxycarbonylamino)-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[2-[[2-(butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]hexanoic acid Formula: C29H40N4O6 MolecularWeight: 540.6511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

CCCCOC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CCCCN)C(=O)O

InChI

InChI=1S/C29H40N4O6/c1-2-3-18-39-29(38)33-25(20-22-14-8-5-9-15-22)27(35)32-24(19-21-12-6-4-7-13-21)26(34)31-23(28(36)37)16-10-11-17-30/h4-9,12-15,23-25H,2-3,10-11,16-20,30H2,1H3,(H,31,34)(H,32,35)(H,33,38)(H,36,37)