1-[(2-chloranyl-4-prop-1-ynyl-phenyl)methyl]indazole-3-carboxylic acid

Systemtic Name: 1-[(2-chloranyl-4-prop-1-ynyl-phenyl)methyl]indazole-3-carboxylic acid Openeye Name: 1-[(2-chloro-4-prop-1-ynyl-phenyl)methyl]indazole-3-carboxylic acid CAS Name: 1-[(2-chloro-4-prop-1-ynylphenyl)methyl]-3-indazolecarboxylic acid IUPAC Name: 1-[(2-chloro-4-prop-1-ynylphenyl)methyl]indazole-3-carboxylic acid Traditional Name: 1-(2-chloro-4-prop-1-ynyl-benzyl)indazole-3-carboxylic acid Formula: C18H13ClN2O2 MolecularWeight: 324.76102

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=C(C=C1)CN2C3=CC=CC=C3C(=N2)C(=O)O)Cl

Isomeric SMILES

CC#CC1=CC(=C(C=C1)CN2C3=CC=CC=C3C(=N2)C(=O)O)Cl

InChI

InChI=1S/C18H13ClN2O2/c1-2-5-12-8-9-13(15(19)10-12)11-21-16-7-4-3-6-14(16)17(20-21)18(22)23/h3-4,6-10H,11H2,1H3,(H,22,23)