4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-(4-isopropyl-3-methyl-phenoxy)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(3-methyl-4-propan-2-ylphenoxy)ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-(3-methyl-4-propan-2-ylphenoxy)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(4-isopropyl-3-methyl-phenoxy)ethylamino]-4-keto-butyrate Formula: C16H22NO4- MolecularWeight: 292.35018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCNC(=O)CCC(=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCNC(=O)CCC(=O)[O-])C(C)C

InChI

InChI=1S/C16H23NO4/c1-11(2)14-5-4-13(10-12(14)3)21-9-8-17-15(18)6-7-16(19)20/h4-5,10-11H,6-9H2,1-3H3,(H,17,18)(H,19,20)/p-1