2-aminocarbonyl-7-(1,3-benzodioxol-5-yl)-2-(5-naphthalen-2-ylpentoxymethyl)heptanoic acid

Systemtic Name: 2-aminocarbonyl-7-(1,3-benzodioxol-5-yl)-2-(5-naphthalen-2-ylpentoxymethyl)heptanoic acid Openeye Name: 7-(1,3-benzodioxol-5-yl)-2-carbamoyl-2-[5-(2-naphthyl)pentoxymethyl]heptanoic acid CAS Name: 7-(1,3-benzodioxol-5-yl)-2-carbamoyl-2-[5-(2-naphthalenyl)pentoxymethyl]heptanoic acid IUPAC Name: 7-(1,3-benzodioxol-5-yl)-2-carbamoyl-2-(5-naphthalen-2-ylpentoxymethyl)heptanoic acid Traditional Name: 7-(1,3-benzodioxol-5-yl)-2-carbamoyl-2-[5-(2-naphthyl)pentoxymethyl]enanthic acid Formula: C31H37NO6 MolecularWeight: 519.62858

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCCCCC(COCCCCCC3=CC4=CC=CC=C4C=C3)(C(=O)N)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCCCCC(COCCCCCC3=CC4=CC=CC=C4C=C3)(C(=O)N)C(=O)O

InChI

InChI=1S/C31H37NO6/c32-29(33)31(30(34)35,17-7-1-3-10-24-14-16-27-28(20-24)38-22-37-27)21-36-18-8-2-4-9-23-13-15-25-11-5-6-12-26(25)19-23/h5-6,11-16,19-20H,1-4,7-10,17-18,21-22H2,(H2,32,33)(H,34,35)