4-[[3-[3,6-bis(bromanyl)carbazol-9-yl]-2-oxidanyl-propyl]amino]benzoic acid

Systemtic Name: 4-[[3-[3,6-bis(bromanyl)carbazol-9-yl]-2-oxidanyl-propyl]amino]benzoic acid Openeye Name: 4-[[3-(3,6-dibromocarbazol-9-yl)-2-hydroxy-propyl]amino]benzoic acid CAS Name: 4-[[3-(3,6-dibromo-9-carbazolyl)-2-hydroxypropyl]amino]benzoic acid IUPAC Name: 4-[[3-(3,6-dibromocarbazol-9-yl)-2-hydroxypropyl]amino]benzoic acid Traditional Name: 4-[[3-(3,6-dibromocarbazol-9-yl)-2-hydroxy-propyl]amino]benzoic acid Formula: C22H18Br2N2O3 MolecularWeight: 518.19792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCC(CN2C3=C(C=C(C=C3)Br)C4=C2C=CC(=C4)Br)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCC(CN2C3=C(C=C(C=C3)Br)C4=C2C=CC(=C4)Br)O

InChI

InChI=1S/C22H18Br2N2O3/c23-14-3-7-20-18(9-14)19-10-15(24)4-8-21(19)26(20)12-17(27)11-25-16-5-1-13(2-6-16)22(28)29/h1-10,17,25,27H,11-12H2,(H,28,29)