4-chloranyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-benzenesulfonic acid

Systemtic Name: 4-chloranyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-benzenesulfonic acid Openeye Name: 4-chloro-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-benzenesulfonic acid CAS Name: 4-chloro-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-methylbenzenesulfonic acid IUPAC Name: 4-chloro-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methylbenzenesulfonic acid Traditional Name: 4-chloro-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-besylic acid Formula: C22H18ClNO5S MolecularWeight: 443.90002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)S(=O)(=O)O

InChI

InChI=1S/C22H18ClNO5S/c1-13-10-21(30(26,27)28)20(11-19(13)23)24-22(25)29-12-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11,18H,12H2,1H3,(H,24,25)(H,26,27,28)