6-(3,3-dimethylbut-1-en-2-yl)-2-oxidanylidene-3-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]pyridine-1-carboxylic acid

Systemtic Name: 6-(3,3-dimethylbut-1-en-2-yl)-2-oxidanylidene-3-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]pyridine-1-carboxylic acid Openeye Name: 3-[(2-benzyloxy-2-oxo-ethyl)amino]-6-(2,2-dimethyl-1-methylene-propyl)-2-oxo-pyridine-1-carboxylic acid CAS Name: 6-(3,3-dimethylbut-1-en-2-yl)-2-oxo-3-[(2-oxo-2-phenylmethoxyethyl)amino]-1-pyridinecarboxylic acid IUPAC Name: 6-(3,3-dimethylbut-1-en-2-yl)-2-oxo-3-[(2-oxo-2-phenylmethoxyethyl)amino]pyridine-1-carboxylic acid Traditional Name: 3-[(2-benzoxy-2-keto-ethyl)amino]-6-(1-tert-butylvinyl)-2-keto-pyridine-1-carboxylic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C)C1=CC=C(C(=O)N1C(=O)O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=C)C1=CC=C(C(=O)N1C(=O)O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5/c1-14(21(2,3)4)17-11-10-16(19(25)23(17)20(26)27)22-12-18(24)28-13-15-8-6-5-7-9-15/h5-11,22H,1,12-13H2,2-4H3,(H,26,27)