4-[2-[2-[3-(dimethylamino)propoxy]naphthalen-1-yl]ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[2-[3-(dimethylamino)propoxy]naphthalen-1-yl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[2-[3-(dimethylamino)propoxy]-1-naphthyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[2-[3-(dimethylamino)propoxy]-1-naphthalenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[2-[3-(dimethylamino)propoxy]naphthalen-1-yl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-[2-[3-(dimethylamino)propoxy]-1-naphthyl]ethylamino]-4-keto-butyric acid Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C2=CC=CC=C2C=C1)CCNC(=O)CCC(=O)O

Isomeric SMILES

CN(C)CCCOC1=C(C2=CC=CC=C2C=C1)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C21H28N2O4/c1-23(2)14-5-15-27-19-9-8-16-6-3-4-7-17(16)18(19)12-13-22-20(24)10-11-21(25)26/h3-4,6-9H,5,10-15H2,1-2H3,(H,22,24)(H,25,26)