2-azanyl-4-(2-butoxyphenyl)-2-(2-methylpropyl)-3-oxidanylidene-hexanoic acid

Systemtic Name: 2-azanyl-4-(2-butoxyphenyl)-2-(2-methylpropyl)-3-oxidanylidene-hexanoic acid Openeye Name: 2-amino-4-(2-butoxyphenyl)-2-isobutyl-3-oxo-hexanoic acid CAS Name: 2-amino-4-(2-butoxyphenyl)-2-(2-methylpropyl)-3-oxohexanoic acid IUPAC Name: 2-amino-4-(2-butoxyphenyl)-2-(2-methylpropyl)-3-oxohexanoic acid Traditional Name: 2-amino-4-(2-butoxyphenyl)-2-isobutyl-3-keto-hexanoic acid Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(CC)C(=O)C(CC(C)C)(C(=O)O)N

Isomeric SMILES

CCCCOC1=CC=CC=C1C(CC)C(=O)C(CC(C)C)(C(=O)O)N

InChI

InChI=1S/C20H31NO4/c1-5-7-12-25-17-11-9-8-10-16(17)15(6-2)18(22)20(21,19(23)24)13-14(3)4/h8-11,14-15H,5-7,12-13,21H2,1-4H3,(H,23,24)