3-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-[(7-fluoranylnaphthalen-1-yl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-[(7-fluoranylnaphthalen-1-yl)methyl]indole-2-carboxylic acid Openeye Name: 3-[2-(dimethylamino)-2-oxo-ethyl]-1-[(7-fluoro-1-naphthyl)methyl]indole-2-carboxylic acid CAS Name: 3-[2-(dimethylamino)-2-oxoethyl]-1-[(7-fluoro-1-naphthalenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-[2-(dimethylamino)-2-oxoethyl]-1-[(7-fluoronaphthalen-1-yl)methyl]indole-2-carboxylic acid Traditional Name: 3-[2-(dimethylamino)-2-keto-ethyl]-1-[(7-fluoro-1-naphthyl)methyl]indole-2-carboxylic acid Formula: C24H21FN2O3 MolecularWeight: 404.433543

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CC1=C(N(C2=CC=CC=C21)CC3=CC=CC4=C3C=C(C=C4)F)C(=O)O

Isomeric SMILES

CN(C)C(=O)CC1=C(N(C2=CC=CC=C21)CC3=CC=CC4=C3C=C(C=C4)F)C(=O)O

InChI

InChI=1S/C24H21FN2O3/c1-26(2)22(28)13-20-18-8-3-4-9-21(18)27(23(20)24(29)30)14-16-7-5-6-15-10-11-17(25)12-19(15)16/h3-12H,13-14H2,1-2H3,(H,29,30)