4-[7-[5-(dimethylamino)-5-oxidanylidene-pentyl]naphthalen-1-yl]-3-methoxy-2-methyl-benzoic acid

Systemtic Name: 4-[7-[5-(dimethylamino)-5-oxidanylidene-pentyl]naphthalen-1-yl]-3-methoxy-2-methyl-benzoic acid Openeye Name: 4-[7-[5-(dimethylamino)-5-oxo-pentyl]-1-naphthyl]-3-methoxy-2-methyl-benzoic acid CAS Name: 4-[7-[5-(dimethylamino)-5-oxopentyl]-1-naphthalenyl]-3-methoxy-2-methylbenzoic acid IUPAC Name: 4-[7-[5-(dimethylamino)-5-oxopentyl]naphthalen-1-yl]-3-methoxy-2-methylbenzoic acid Traditional Name: 4-[7-[5-(dimethylamino)-5-keto-pentyl]-1-naphthyl]-3-methoxy-2-methyl-benzoic acid Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)C2=CC=CC3=C2C=C(C=C3)CCCCC(=O)N(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1OC)C2=CC=CC3=C2C=C(C=C3)CCCCC(=O)N(C)C)C(=O)O

InChI

InChI=1S/C26H29NO4/c1-17-20(26(29)30)14-15-22(25(17)31-4)21-10-7-9-19-13-12-18(16-23(19)21)8-5-6-11-24(28)27(2)3/h7,9-10,12-16H,5-6,8,11H2,1-4H3,(H,29,30)