[(Z)-[1-[(4-chlorophenyl)methyl]-5-nitro-2-oxidanylidene-indol-3-ylidene]amino] 3-methylbutanoate

Systemtic Name: [(Z)-[1-[(4-chlorophenyl)methyl]-5-nitro-2-oxidanylidene-indol-3-ylidene]amino] 3-methylbutanoate Openeye Name: [(Z)-[1-[(4-chlorophenyl)methyl]-5-nitro-2-oxo-indolin-3-ylidene]amino] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [(Z)-[1-[(4-chlorophenyl)methyl]-5-nitro-2-oxo-3-indolylidene]amino] ester IUPAC Name: [(Z)-[1-[(4-chlorophenyl)methyl]-5-nitro-2-oxoindol-3-ylidene]amino] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [(Z)-[1-(4-chlorobenzyl)-2-keto-5-nitro-indolin-3-ylidene]amino] ester Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)ON=C1C2=C(C=CC(=C2)[N+](=O)[O-])N(C1=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CC(=O)O/N=C\1/C2=C(C=CC(=C2)[N+](=O)[O-])N(C1=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3O5/c1-12(2)9-18(25)29-22-19-16-10-15(24(27)28)7-8-17(16)23(20(19)26)11-13-3-5-14(21)6-4-13/h3-8,10,12H,9,11H2,1-2H3/b22-19-