1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]azecane-2-carboxylic acid

Systemtic Name: 1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]azecane-2-carboxylic acid Openeye Name: 1-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]azecane-2-carboxylic acid CAS Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-2-azecanecarboxylic acid IUPAC Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]azecane-2-carboxylic acid Traditional Name: 1-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]azecane-2-carboxylic acid Formula: C25H38N2O5 MolecularWeight: 446.57962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCCCCCCC2C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCCCCCCC2C(=O)O

InChI

InChI=1S/C25H38N2O5/c1-3-32-25(31)21(17-16-20-13-9-8-10-14-20)26-19(2)23(28)27-18-12-7-5-4-6-11-15-22(27)24(29)30/h8-10,13-14,19,21-22,26H,3-7,11-12,15-18H2,1-2H3,(H,29,30)