4-chloranyl-2-[3-[methyl(phenyl)amino]propyliminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[3-[methyl(phenyl)amino]propyliminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[3-(N-methylanilino)propyliminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[3-(N-methylanilino)propyliminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[3-(N-methylanilino)propyliminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[3-(N-methylanilino)propyliminomethyl]-6-nitro-phenolate Formula: C17H17ClN3O3- MolecularWeight: 346.78818

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl)C2=CC=CC=C2

Isomeric SMILES

CN(CCCN=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl)C2=CC=CC=C2

InChI

InChI=1S/C17H18ClN3O3/c1-20(15-6-3-2-4-7-15)9-5-8-19-12-13-10-14(18)11-16(17(13)22)21(23)24/h2-4,6-7,10-12,22H,5,8-9H2,1H3/p-1