2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl-(oxolan-2-ylmethyl)amino]ethanoic acid

Systemtic Name: 2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl-(oxolan-2-ylmethyl)amino]ethanoic acid Openeye Name: 2-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl-(tetrahydrofuran-2-ylmethyl)amino]acetic acid CAS Name: 2-[[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-(2-oxolanylmethyl)amino]acetic acid IUPAC Name: 2-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl-(oxolan-2-ylmethyl)amino]acetic acid Traditional Name: 2-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl-(tetrahydrofurfuryl)amino]acetic acid Formula: C22H32N2O6 MolecularWeight: 420.49928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC2CCCO2)CC(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC2CCCO2)CC(=O)O

InChI

InChI=1S/C22H32N2O6/c1-3-29-22(28)19(12-11-17-8-5-4-6-9-17)23-16(2)21(27)24(15-20(25)26)14-18-10-7-13-30-18/h4-6,8-9,16,18-19,23H,3,7,10-15H2,1-2H3,(H,25,26)