2-[7-chloranyl-5-(2-fluorophenyl)-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-oxidanylidene-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[7-chloranyl-5-(2-fluorophenyl)-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-oxidanylidene-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-[tert-butoxycarbonyl(methyl)amino]-7-chloro-5-(2-fluorophenyl)-2-oxo-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[7-chloro-5-(2-fluorophenyl)-3-[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[7-chloro-5-(2-fluorophenyl)-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-oxo-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[3-[tert-butoxycarbonyl(methyl)amino]-7-chloro-5-(2-fluorophenyl)-2-keto-3H-1-benzazepin-1-yl]acetic acid Formula: C24H24ClFN2O5 MolecularWeight: 474.909163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C1C=C(C2=C(C=CC(=C2)Cl)N(C1=O)CC(=O)O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C1C=C(C2=C(C=CC(=C2)Cl)N(C1=O)CC(=O)O)C3=CC=CC=C3F

InChI

InChI=1S/C24H24ClFN2O5/c1-24(2,3)33-23(32)27(4)20-12-16(15-7-5-6-8-18(15)26)17-11-14(25)9-10-19(17)28(22(20)31)13-21(29)30/h5-12,20H,13H2,1-4H3,(H,29,30)