4-[2-[4-(4-chloranyl-3-methyl-phenoxy)phenyl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-[4-(4-chloranyl-3-methyl-phenoxy)phenyl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-[4-(4-chloro-3-methyl-phenoxy)phenyl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[4-(4-chloro-3-methylphenoxy)phenyl]ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-[4-(4-chloro-3-methylphenoxy)phenyl]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[4-(4-chloro-3-methyl-phenoxy)phenyl]ethylamino]-4-keto-butyrate Formula: C19H19ClNO4- MolecularWeight: 360.81146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)CCNC(=O)CCC(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)CCNC(=O)CCC(=O)[O-])Cl

InChI

InChI=1S/C19H20ClNO4/c1-13-12-16(6-7-17(13)20)25-15-4-2-14(3-5-15)10-11-21-18(22)8-9-19(23)24/h2-7,12H,8-11H2,1H3,(H,21,22)(H,23,24)/p-1