2-(octan-3-ylcarbamoyl)naphthalene-1-carboxylic acid

Systemtic Name: 2-(octan-3-ylcarbamoyl)naphthalene-1-carboxylic acid Openeye Name: 2-(1-ethylhexylcarbamoyl)naphthalene-1-carboxylic acid CAS Name: 2-[(octan-3-ylamino)-oxomethyl]-1-naphthalenecarboxylic acid IUPAC Name: 2-(octan-3-ylcarbamoyl)naphthalene-1-carboxylic acid Traditional Name: 2-(1-ethylhexylcarbamoyl)-1-naphthoic acid Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC(=O)C1=C(C2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

CCCCCC(CC)NC(=O)C1=C(C2=CC=CC=C2C=C1)C(=O)O

InChI

InChI=1S/C20H25NO3/c1-3-5-6-10-15(4-2)21-19(22)17-13-12-14-9-7-8-11-16(14)18(17)20(23)24/h7-9,11-13,15H,3-6,10H2,1-2H3,(H,21,22)(H,23,24)