2-aminocarbonyl-9-(3-chloranyl-4-methyl-phenyl)-2-(5-naphthalen-2-ylpentoxymethyl)nonanoic acid

Systemtic Name: 2-aminocarbonyl-9-(3-chloranyl-4-methyl-phenyl)-2-(5-naphthalen-2-ylpentoxymethyl)nonanoic acid Openeye Name: 2-carbamoyl-9-(3-chloro-4-methyl-phenyl)-2-[5-(2-naphthyl)pentoxymethyl]nonanoic acid CAS Name: 2-carbamoyl-9-(3-chloro-4-methylphenyl)-2-[5-(2-naphthalenyl)pentoxymethyl]nonanoic acid IUPAC Name: 2-carbamoyl-9-(3-chloro-4-methylphenyl)-2-(5-naphthalen-2-ylpentoxymethyl)nonanoic acid Traditional Name: 2-carbamoyl-9-(3-chloro-4-methyl-phenyl)-2-[5-(2-naphthyl)pentoxymethyl]pelargonic acid Formula: C33H42ClNO4 MolecularWeight: 552.14388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCCCCCC(COCCCCCC2=CC3=CC=CC=C3C=C2)(C(=O)N)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCCCCCCC(COCCCCCC2=CC3=CC=CC=C3C=C2)(C(=O)N)C(=O)O)Cl

InChI

InChI=1S/C33H42ClNO4/c1-25-16-17-27(23-30(25)34)13-6-3-2-4-10-20-33(31(35)36,32(37)38)24-39-21-11-5-7-12-26-18-19-28-14-8-9-15-29(28)22-26/h8-9,14-19,22-23H,2-7,10-13,20-21,24H2,1H3,(H2,35,36)(H,37,38)