7-oxidanyl-3-[(pentylamino)methyl]naphthalene-2-carboxylic acid

Systemtic Name: 7-oxidanyl-3-[(pentylamino)methyl]naphthalene-2-carboxylic acid Openeye Name: 7-hydroxy-3-[(pentylamino)methyl]naphthalene-2-carboxylic acid CAS Name: 7-hydroxy-3-[(pentylamino)methyl]-2-naphthalenecarboxylic acid IUPAC Name: 7-hydroxy-3-[(pentylamino)methyl]naphthalene-2-carboxylic acid Traditional Name: 3-[(amylamino)methyl]-7-hydroxy-2-naphthoic acid Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=C(C=C2C=C(C=CC2=C1)O)C(=O)O

Isomeric SMILES

CCCCCNCC1=C(C=C2C=C(C=CC2=C1)O)C(=O)O

InChI

InChI=1S/C17H21NO3/c1-2-3-4-7-18-11-14-8-12-5-6-15(19)9-13(12)10-16(14)17(20)21/h5-6,8-10,18-19H,2-4,7,11H2,1H3,(H,20,21)