4-[(4-dodecylphenyl)methoxy]-6-methoxy-quinoline-2-carboxylic acid

Systemtic Name: 4-[(4-dodecylphenyl)methoxy]-6-methoxy-quinoline-2-carboxylic acid Openeye Name: 4-[(4-dodecylphenyl)methoxy]-6-methoxy-quinoline-2-carboxylic acid CAS Name: 4-[(4-dodecylphenyl)methoxy]-6-methoxy-2-quinolinecarboxylic acid IUPAC Name: 4-[(4-dodecylphenyl)methoxy]-6-methoxyquinoline-2-carboxylic acid Traditional Name: 4-(4-laurylbenzyl)oxy-6-methoxy-quinaldic acid Formula: C30H39NO4 MolecularWeight: 477.63496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)COC2=CC(=NC3=C2C=C(C=C3)OC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)COC2=CC(=NC3=C2C=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C30H39NO4/c1-3-4-5-6-7-8-9-10-11-12-13-23-14-16-24(17-15-23)22-35-29-21-28(30(32)33)31-27-19-18-25(34-2)20-26(27)29/h14-21H,3-13,22H2,1-2H3,(H,32,33)