3-methoxy-4-[[7-[2-methyl-3-oxidanylidene-3-(propylamino)propyl]naphthalen-1-yl]methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[[7-[2-methyl-3-oxidanylidene-3-(propylamino)propyl]naphthalen-1-yl]methyl]benzoic acid Openeye Name: 3-methoxy-4-[[7-[2-methyl-3-oxo-3-(propylamino)propyl]-1-naphthyl]methyl]benzoic acid CAS Name: 3-methoxy-4-[[7-[2-methyl-3-oxo-3-(propylamino)propyl]-1-naphthalenyl]methyl]benzoic acid IUPAC Name: 3-methoxy-4-[[7-[2-methyl-3-oxo-3-(propylamino)propyl]naphthalen-1-yl]methyl]benzoic acid Traditional Name: 4-[[7-[3-keto-2-methyl-3-(propylamino)propyl]-1-naphthyl]methyl]-3-methoxy-benzoic acid Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)CC1=CC2=C(C=CC=C2CC3=C(C=C(C=C3)C(=O)O)OC)C=C1

Isomeric SMILES

CCCNC(=O)C(C)CC1=CC2=C(C=CC=C2CC3=C(C=C(C=C3)C(=O)O)OC)C=C1

InChI

InChI=1S/C26H29NO4/c1-4-12-27-25(28)17(2)13-18-8-9-19-6-5-7-20(23(19)14-18)15-21-10-11-22(26(29)30)16-24(21)31-3/h5-11,14,16-17H,4,12-13,15H2,1-3H3,(H,27,28)(H,29,30)