3-(4-methylpentylcarbamoyl)naphthalene-2-carboxylic acid

Systemtic Name: 3-(4-methylpentylcarbamoyl)naphthalene-2-carboxylic acid Openeye Name: 3-(isohexylcarbamoyl)naphthalene-2-carboxylic acid CAS Name: 3-[(4-methylpentylamino)-oxomethyl]-2-naphthalenecarboxylic acid IUPAC Name: 3-(4-methylpentylcarbamoyl)naphthalene-2-carboxylic acid Traditional Name: 3-(isohexylcarbamoyl)-2-naphthoic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCNC(=O)C1=CC2=CC=CC=C2C=C1C(=O)O

Isomeric SMILES

CC(C)CCCNC(=O)C1=CC2=CC=CC=C2C=C1C(=O)O

InChI

InChI=1S/C18H21NO3/c1-12(2)6-5-9-19-17(20)15-10-13-7-3-4-8-14(13)11-16(15)18(21)22/h3-4,7-8,10-12H,5-6,9H2,1-2H3,(H,19,20)(H,21,22)