2-aminocarbonyl-7-naphthalen-2-yl-2-[4-(naphthalen-2-ylamino)butoxymethyl]heptanoic acid

Systemtic Name: 2-aminocarbonyl-7-naphthalen-2-yl-2-[4-(naphthalen-2-ylamino)butoxymethyl]heptanoic acid Openeye Name: 2-carbamoyl-7-(2-naphthyl)-2-[4-(2-naphthylamino)butoxymethyl]heptanoic acid CAS Name: 2-carbamoyl-7-(2-naphthalenyl)-2-[4-(2-naphthalenylamino)butoxymethyl]heptanoic acid IUPAC Name: 2-carbamoyl-7-naphthalen-2-yl-2-[4-(naphthalen-2-ylamino)butoxymethyl]heptanoic acid Traditional Name: 2-carbamoyl-7-(2-naphthyl)-2-[4-(2-naphthylamino)butoxymethyl]enanthic acid Formula: C33H38N2O4 MolecularWeight: 526.66582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCCCCC(COCCCCNC3=CC4=CC=CC=C4C=C3)(C(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCCCCC(COCCCCNC3=CC4=CC=CC=C4C=C3)(C(=O)N)C(=O)O

InChI

InChI=1S/C33H38N2O4/c34-31(36)33(32(37)38,19-7-1-2-10-25-15-16-26-11-3-5-13-28(26)22-25)24-39-21-9-8-20-35-30-18-17-27-12-4-6-14-29(27)23-30/h3-6,11-18,22-23,35H,1-2,7-10,19-21,24H2,(H2,34,36)(H,37,38)