2-aminocarbonyl-7-naphthalen-2-yl-2-[5-(1H-pyrrol-3-yl)pentoxymethyl]heptanoic acid

Systemtic Name: 2-aminocarbonyl-7-naphthalen-2-yl-2-[5-(1H-pyrrol-3-yl)pentoxymethyl]heptanoic acid Openeye Name: 2-carbamoyl-7-(2-naphthyl)-2-[5-(1H-pyrrol-3-yl)pentoxymethyl]heptanoic acid CAS Name: 2-carbamoyl-7-(2-naphthalenyl)-2-[5-(1H-pyrrol-3-yl)pentoxymethyl]heptanoic acid IUPAC Name: 2-carbamoyl-7-naphthalen-2-yl-2-[5-(1H-pyrrol-3-yl)pentoxymethyl]heptanoic acid Traditional Name: 2-carbamoyl-7-(2-naphthyl)-2-[5-(1H-pyrrol-3-yl)pentoxymethyl]enanthic acid Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O4/c29-26(31)28(27(32)33,21-34-18-8-2-4-10-23-15-17-30-20-23)16-7-1-3-9-22-13-14-24-11-5-6-12-25(24)19-22/h5-6,11-15,17,19-20,30H,1-4,7-10,16,18,21H2,(H2,29,31)(H,32,33)