6-[2-fluoranyl-4-(propan-2-ylamino)phenyl]-1,5-dimethoxy-naphthalene-2-carboxylic acid

Systemtic Name: 6-[2-fluoranyl-4-(propan-2-ylamino)phenyl]-1,5-dimethoxy-naphthalene-2-carboxylic acid Openeye Name: 6-[2-fluoro-4-(isopropylamino)phenyl]-1,5-dimethoxy-naphthalene-2-carboxylic acid CAS Name: 6-[2-fluoro-4-(propan-2-ylamino)phenyl]-1,5-dimethoxy-2-naphthalenecarboxylic acid IUPAC Name: 6-[2-fluoro-4-(propan-2-ylamino)phenyl]-1,5-dimethoxynaphthalene-2-carboxylic acid Traditional Name: 6-[2-fluoro-4-(isopropylamino)phenyl]-1,5-dimethoxy-2-naphthoic acid Formula: C22H22FNO4 MolecularWeight: 383.412783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC(=C(C=C1)C2=C(C3=C(C=C2)C(=C(C=C3)C(=O)O)OC)OC)F

Isomeric SMILES

CC(C)NC1=CC(=C(C=C1)C2=C(C3=C(C=C2)C(=C(C=C3)C(=O)O)OC)OC)F

InChI

InChI=1S/C22H22FNO4/c1-12(2)24-13-5-6-14(19(23)11-13)15-7-8-17-16(20(15)27-3)9-10-18(22(25)26)21(17)28-4/h5-12,24H,1-4H3,(H,25,26)