2-(7-chloranyl-3-methoxycarbonyl-4,5-dihydrobenzo[g]indazol-1-yl)benzoic acid

Systemtic Name: 2-(7-chloranyl-3-methoxycarbonyl-4,5-dihydrobenzo[g]indazol-1-yl)benzoic acid Openeye Name: 2-(7-chloro-3-methoxycarbonyl-4,5-dihydrobenzo[g]indazol-1-yl)benzoic acid CAS Name: 2-(7-chloro-3-methoxycarbonyl-4,5-dihydrobenzo[g]indazol-1-yl)benzoic acid IUPAC Name: 2-(7-chloro-3-methoxycarbonyl-4,5-dihydrobenzo[g]indazol-1-yl)benzoic acid Traditional Name: 2-(3-carbomethoxy-7-chloro-4,5-dihydrobenz[g]indazol-1-yl)benzoic acid Formula: C20H15ClN2O4 MolecularWeight: 382.7971

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C2=C1CCC3=C2C=CC(=C3)Cl)C4=CC=CC=C4C(=O)O

Isomeric SMILES

COC(=O)C1=NN(C2=C1CCC3=C2C=CC(=C3)Cl)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C20H15ClN2O4/c1-27-20(26)17-15-8-6-11-10-12(21)7-9-13(11)18(15)23(22-17)16-5-3-2-4-14(16)19(24)25/h2-5,7,9-10H,6,8H2,1H3,(H,24,25)