2,2-dimethylpropanoyloxymethyl 4,6-bis(chloranyl)-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-indole-2-carboxylate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 4,6-bis(chloranyl)-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-indole-2-carboxylate Openeye Name: 2,2-dimethylpropanoyloxymethyl 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylate CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylate Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid pivaloyloxymethyl ester Formula: C24H22Cl2N2O5 MolecularWeight: 489.34788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)C=CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)OCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)/C=C/C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H22Cl2N2O5/c1-24(2,3)23(31)33-13-32-22(30)21-16(20-17(26)11-14(25)12-18(20)28-21)9-10-19(29)27-15-7-5-4-6-8-15/h4-12,28H,13H2,1-3H3,(H,27,29)/b10-9+