5-(7-chloranyl-2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(7-chloranyl-2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)-2-oxidanyl-benzoic acid Openeye Name: 5-(7-chloro-2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)-2-hydroxy-benzoic acid CAS Name: 5-(7-chloro-2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)-2-hydroxybenzoic acid IUPAC Name: 5-(7-chloro-2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)-2-hydroxybenzoic acid Traditional Name: 5-(7-chloro-2-phenyl-4,5-dihydrobenz[e]indol-3-yl)-2-hydroxy-benzoic acid Formula: C25H18ClNO3 MolecularWeight: 415.86832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4)C5=C1C=C(C=C5)Cl

Isomeric SMILES

C1CC2=C(C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4)C5=C1C=C(C=C5)Cl

InChI

InChI=1S/C25H18ClNO3/c26-17-7-9-19-16(12-17)6-10-22-20(19)14-23(15-4-2-1-3-5-15)27(22)18-8-11-24(28)21(13-18)25(29)30/h1-5,7-9,11-14,28H,6,10H2,(H,29,30)