2-aminocarbonyl-7-naphthalen-2-yl-2-(5-thiophen-3-ylpentoxymethyl)heptanoic acid

Systemtic Name: 2-aminocarbonyl-7-naphthalen-2-yl-2-(5-thiophen-3-ylpentoxymethyl)heptanoic acid Openeye Name: 2-carbamoyl-7-(2-naphthyl)-2-[5-(3-thienyl)pentoxymethyl]heptanoic acid CAS Name: 2-carbamoyl-7-(2-naphthalenyl)-2-[5-(3-thiophenyl)pentoxymethyl]heptanoic acid IUPAC Name: 2-carbamoyl-7-naphthalen-2-yl-2-(5-thiophen-3-ylpentoxymethyl)heptanoic acid Traditional Name: 2-carbamoyl-7-(2-naphthyl)-2-[5-(3-thienyl)pentoxymethyl]enanthic acid Formula: C28H35NO4S MolecularWeight: 481.6468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCCCCC(COCCCCCC3=CSC=C3)(C(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCCCCC(COCCCCCC3=CSC=C3)(C(=O)N)C(=O)O

InChI

InChI=1S/C28H35NO4S/c29-26(30)28(27(31)32,21-33-17-8-2-4-10-23-15-18-34-20-23)16-7-1-3-9-22-13-14-24-11-5-6-12-25(24)19-22/h5-6,11-15,18-20H,1-4,7-10,16-17,21H2,(H2,29,30)(H,31,32)