methyl 4-[1-[[2-chloranyl-5-(prop-2-enoylamino)phenyl]amino]-4,4-dimethyl-1,3-bis(oxidanylidene)pentan-2-yl]oxybenzoate

Systemtic Name: methyl 4-[1-[[2-chloranyl-5-(prop-2-enoylamino)phenyl]amino]-4,4-dimethyl-1,3-bis(oxidanylidene)pentan-2-yl]oxybenzoate Openeye Name: methyl 4-[1-[[2-chloro-5-(prop-2-enoylamino)phenyl]carbamoyl]-3,3-dimethyl-2-oxo-butoxy]benzoate CAS Name: 4-[1-[2-chloro-5-(1-oxoprop-2-enylamino)anilino]-4,4-dimethyl-1,3-dioxopentan-2-yl]oxybenzoic acid methyl ester IUPAC Name: methyl 4-[1-[2-chloro-5-(prop-2-enoylamino)anilino]-4,4-dimethyl-1,3-dioxopentan-2-yl]oxybenzoate Traditional Name: 4-[1-[(5-acrylamido-2-chloro-phenyl)carbamoyl]-2-keto-3,3-dimethyl-butoxy]benzoic acid methyl ester Formula: C24H25ClN2O6 MolecularWeight: 472.9181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C(=O)NC1=C(C=CC(=C1)NC(=O)C=C)Cl)OC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)C(C(=O)NC1=C(C=CC(=C1)NC(=O)C=C)Cl)OC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C24H25ClN2O6/c1-6-19(28)26-15-9-12-17(25)18(13-15)27-22(30)20(21(29)24(2,3)4)33-16-10-7-14(8-11-16)23(31)32-5/h6-13,20H,1H2,2-5H3,(H,26,28)(H,27,30)