4-(2-methylbutanoylamino)butyl naphthalene-2-carboxylate

Systemtic Name: 4-(2-methylbutanoylamino)butyl naphthalene-2-carboxylate Openeye Name: 4-(2-methylbutanoylamino)butyl naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid 4-[(2-methyl-1-oxobutyl)amino]butyl ester IUPAC Name: 4-(2-methylbutanoylamino)butyl naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid 4-(2-methylbutanoylamino)butyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCCCCOC(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCC(C)C(=O)NCCCCOC(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C20H25NO3/c1-3-15(2)19(22)21-12-6-7-13-24-20(23)18-11-10-16-8-4-5-9-17(16)14-18/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3,(H,21,22)