2-[[2-oxidanylidene-2-[(9-oxidanylidenefluoren-3-yl)amino]ethyl]-piperidin-4-yl-amino]benzoic acid

Systemtic Name: 2-[[2-oxidanylidene-2-[(9-oxidanylidenefluoren-3-yl)amino]ethyl]-piperidin-4-yl-amino]benzoic acid Openeye Name: 2-[[2-oxo-2-[(9-oxofluoren-3-yl)amino]ethyl]-(4-piperidyl)amino]benzoic acid CAS Name: 2-[[2-oxo-2-[(9-oxo-3-fluorenyl)amino]ethyl]-(4-piperidinyl)amino]benzoic acid IUPAC Name: 2-[[2-oxo-2-[(9-oxofluoren-3-yl)amino]ethyl]-piperidin-4-ylamino]benzoic acid Traditional Name: 2-[[2-keto-2-[(9-ketofluoren-3-yl)amino]ethyl]-(4-piperidyl)amino]benzoic acid Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C43)C5=CC=CC=C5C(=O)O

Isomeric SMILES

C1CNCCC1N(CC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C43)C5=CC=CC=C5C(=O)O

InChI

InChI=1S/C27H25N3O4/c31-25(29-17-9-10-21-23(15-17)19-5-1-2-6-20(19)26(21)32)16-30(18-11-13-28-14-12-18)24-8-4-3-7-22(24)27(33)34/h1-10,15,18,28H,11-14,16H2,(H,29,31)(H,33,34)