4-[3-[4-(4-aminophenyl)butoxy]-4-methoxy-phenyl]-3-methyl-benzoic acid

Systemtic Name: 4-[3-[4-(4-aminophenyl)butoxy]-4-methoxy-phenyl]-3-methyl-benzoic acid Openeye Name: 4-[3-[4-(4-aminophenyl)butoxy]-4-methoxy-phenyl]-3-methyl-benzoic acid CAS Name: 4-[3-[4-(4-aminophenyl)butoxy]-4-methoxyphenyl]-3-methylbenzoic acid IUPAC Name: 4-[3-[4-(4-aminophenyl)butoxy]-4-methoxyphenyl]-3-methylbenzoic acid Traditional Name: 4-[3-[4-(4-aminophenyl)butoxy]-4-methoxy-phenyl]-3-methyl-benzoic acid Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)C2=CC(=C(C=C2)OC)OCCCCC3=CC=C(C=C3)N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)C2=CC(=C(C=C2)OC)OCCCCC3=CC=C(C=C3)N

InChI

InChI=1S/C25H27NO4/c1-17-15-20(25(27)28)8-12-22(17)19-9-13-23(29-2)24(16-19)30-14-4-3-5-18-6-10-21(26)11-7-18/h6-13,15-16H,3-5,14,26H2,1-2H3,(H,27,28)