4-[2-(3-butoxy-4-methoxy-phenyl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-(3-butoxy-4-methoxy-phenyl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-(3-butoxy-4-methoxy-phenyl)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(3-butoxy-4-methoxyphenyl)ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-(3-butoxy-4-methoxyphenyl)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(3-butoxy-4-methoxy-phenyl)ethylamino]-4-keto-butyrate Formula: C17H24NO5- MolecularWeight: 322.37616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CCNC(=O)CCC(=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)CCNC(=O)CCC(=O)[O-])OC

InChI

InChI=1S/C17H25NO5/c1-3-4-11-23-15-12-13(5-6-14(15)22-2)9-10-18-16(19)7-8-17(20)21/h5-6,12H,3-4,7-11H2,1-2H3,(H,18,19)(H,20,21)/p-1