6-azanyl-2-[[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-3-methyl-butanoyl]-(1-ethylpiperidin-3-yl)amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-3-methyl-butanoyl]-(1-ethylpiperidin-3-yl)amino]hexanoic acid Openeye Name: 6-amino-2-[[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]-3-methyl-butanoyl]-(1-ethyl-3-piperidyl)amino]hexanoic acid CAS Name: 6-amino-2-[[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-3-methyl-1-oxobutyl]-(1-ethyl-3-piperidinyl)amino]hexanoic acid IUPAC Name: 6-amino-2-[[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-3-methylbutanoyl]-(1-ethylpiperidin-3-yl)amino]hexanoic acid Traditional Name: 6-amino-2-[[2-[(1-carbethoxy-3-phenyl-propyl)amino]-3-methyl-butanoyl]-(1-ethyl-3-piperidyl)amino]hexanoic acid Formula: C30H50N4O5 MolecularWeight: 546.7418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)N(C(CCCCN)C(=O)O)C(=O)C(C(C)C)NC(CCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCN1CCCC(C1)N(C(CCCCN)C(=O)O)C(=O)C(C(C)C)NC(CCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C30H50N4O5/c1-5-33-20-12-15-24(21-33)34(26(29(36)37)16-10-11-19-31)28(35)27(22(3)4)32-25(30(38)39-6-2)18-17-23-13-8-7-9-14-23/h7-9,13-14,22,24-27,32H,5-6,10-12,15-21,31H2,1-4H3,(H,36,37)