2-[4-[(E)-(6-chloranyl-5-nitro-2-oxidanylidene-1H-indol-3-ylidene)methyl]-2-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-(6-chloranyl-5-nitro-2-oxidanylidene-1H-indol-3-ylidene)methyl]-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-(6-chloro-5-nitro-2-oxo-indolin-3-ylidene)methyl]-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(E)-(6-chloro-5-nitro-2-oxo-1H-indol-3-ylidene)methyl]-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-(6-chloro-5-nitro-2-oxo-1H-indol-3-ylidene)methyl]-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(E)-(6-chloro-2-keto-5-nitro-indolin-3-ylidene)methyl]-2-methoxy-phenoxy]acetonitrile Formula: C18H12ClN3O5 MolecularWeight: 385.75798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C3=CC(=C(C=C3NC2=O)Cl)[N+](=O)[O-])OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C3=CC(=C(C=C3NC2=O)Cl)[N+](=O)[O-])OCC#N

InChI

InChI=1S/C18H12ClN3O5/c1-26-17-7-10(2-3-16(17)27-5-4-20)6-12-11-8-15(22(24)25)13(19)9-14(11)21-18(12)23/h2-3,6-9H,5H2,1H3,(H,21,23)/b12-6+