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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)CC1=C(C(=C(C=C1)C(=O)O)CC2=CC=CC3=CC=CC=C32)OC

Isomeric SMILES

CCCNC(=O)C(C)CC1=C(C(=C(C=C1)C(=O)O)CC2=CC=CC3=CC=CC=C32)OC

InChI

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