7-oxidanylidene-7-[[1-oxidanylidene-3-phenyl-1-[(phenylmethyl)amino]propan-2-yl]-phenethyl-amino]heptanoic acid

Systemtic Name: 7-oxidanylidene-7-[[1-oxidanylidene-3-phenyl-1-[(phenylmethyl)amino]propan-2-yl]-phenethyl-amino]heptanoic acid Openeye Name: 7-[[1-benzyl-2-(benzylamino)-2-oxo-ethyl]-phenethyl-amino]-7-oxo-heptanoic acid CAS Name: 7-oxo-7-[[1-oxo-3-phenyl-1-[(phenylmethyl)amino]propan-2-yl]-phenethylamino]heptanoic acid IUPAC Name: 7-[[1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]-phenethylamino]-7-oxoheptanoic acid Traditional Name: 7-[[1-benzyl-2-(benzylamino)-2-keto-ethyl]-phenethyl-amino]-7-keto-enanthic acid Formula: C31H36N2O4 MolecularWeight: 500.62854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(C(CC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)CCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN(C(CC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)CCCCCC(=O)O

InChI

InChI=1S/C31H36N2O4/c34-29(19-11-4-12-20-30(35)36)33(22-21-25-13-5-1-6-14-25)28(23-26-15-7-2-8-16-26)31(37)32-24-27-17-9-3-10-18-27/h1-3,5-10,13-18,28H,4,11-12,19-24H2,(H,32,37)(H,35,36)