7-azanyl-2-ethyl-3-[methanoyl(phenyl)carbamoyl]-2,6,6-trimethyl-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-azanyl-2-ethyl-3-[methanoyl(phenyl)carbamoyl]-2,6,6-trimethyl-7-oxidanylidene-heptanoic acid Openeye Name: 7-amino-2-ethyl-3-[formyl(phenyl)carbamoyl]-2,6,6-trimethyl-7-oxo-heptanoic acid CAS Name: 7-amino-2-ethyl-3-[(N-formylanilino)-oxomethyl]-2,6,6-trimethyl-7-oxoheptanoic acid IUPAC Name: 7-amino-2-ethyl-3-[formyl(phenyl)carbamoyl]-2,6,6-trimethyl-7-oxoheptanoic acid Traditional Name: 7-amino-2-ethyl-3-[formyl(phenyl)carbamoyl]-7-keto-2,6,6-trimethyl-enanthic acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(CCC(C)(C)C(=O)N)C(=O)N(C=O)C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCC(C)(C(CCC(C)(C)C(=O)N)C(=O)N(C=O)C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C20H28N2O5/c1-5-20(4,18(26)27)15(11-12-19(2,3)17(21)25)16(24)22(13-23)14-9-7-6-8-10-14/h6-10,13,15H,5,11-12H2,1-4H3,(H2,21,25)(H,26,27)