1-[4-[(2S)-2-chloranyl-4-methyl-pentoxy]carbonylphenyl]-6-prop-2-enoxy-naphthalene-2-carboxylic acid

Systemtic Name: 1-[4-[(2S)-2-chloranyl-4-methyl-pentoxy]carbonylphenyl]-6-prop-2-enoxy-naphthalene-2-carboxylic acid Openeye Name: 6-allyloxy-1-[4-[(2S)-2-chloro-4-methyl-pentoxy]carbonylphenyl]naphthalene-2-carboxylic acid CAS Name: 1-[4-[[(2S)-2-chloro-4-methylpentoxy]-oxomethyl]phenyl]-6-prop-2-enoxy-2-naphthalenecarboxylic acid IUPAC Name: 1-[4-[(2S)-2-chloro-4-methylpentoxy]carbonylphenyl]-6-prop-2-enoxynaphthalene-2-carboxylic acid Traditional Name: 6-allyloxy-1-[4-[(2S)-2-chloro-4-methyl-pentoxy]carbonylphenyl]-2-naphthoic acid Formula: C27H27ClO5 MolecularWeight: 466.95328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(COC(=O)C1=CC=C(C=C1)C2=C(C=CC3=C2C=CC(=C3)OCC=C)C(=O)O)Cl

Isomeric SMILES

CC(C)C[C@@H](COC(=O)C1=CC=C(C=C1)C2=C(C=CC3=C2C=CC(=C3)OCC=C)C(=O)O)Cl

InChI

InChI=1S/C27H27ClO5/c1-4-13-32-22-10-12-23-20(15-22)9-11-24(26(29)30)25(23)18-5-7-19(8-6-18)27(31)33-16-21(28)14-17(2)3/h4-12,15,17,21H,1,13-14,16H2,2-3H3,(H,29,30)/t21-/m0/s1