5-[(3,3-dimethyl-2-methylidene-1-propan-2-yl-indol-4-yl)amino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(3,3-dimethyl-2-methylidene-1-propan-2-yl-indol-4-yl)amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[(1-isopropyl-3,3-dimethyl-2-methylene-indolin-4-yl)amino]benzoic acid CAS Name: 5-[(3,3-dimethyl-2-methylene-1-propan-2-yl-4-indolyl)amino]-2-hydroxybenzoic acid IUPAC Name: 5-[(3,3-dimethyl-2-methylidene-1-propan-2-ylindol-4-yl)amino]-2-hydroxybenzoic acid Traditional Name: 2-hydroxy-5-[(1-isopropyl-3,3-dimethyl-2-methylene-indolin-4-yl)amino]benzoic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C)C(C2=C1C=CC=C2NC3=CC(=C(C=C3)O)C(=O)O)(C)C

Isomeric SMILES

CC(C)N1C(=C)C(C2=C1C=CC=C2NC3=CC(=C(C=C3)O)C(=O)O)(C)C

InChI

InChI=1S/C21H24N2O3/c1-12(2)23-13(3)21(4,5)19-16(7-6-8-17(19)23)22-14-9-10-18(24)15(11-14)20(25)26/h6-12,22,24H,3H2,1-2,4-5H3,(H,25,26)