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4-nitro-2-[(1-pentylbenzimidazol-2-yl)iminomethyl]phenolate

4-nitro-2-[(1-pentylbenzimidazol-2-yl)iminomethyl]phenolate

Systemtic Name:4-nitro-2-[(1-pentylbenzimidazol-2-yl)iminomethyl]phenolate
Openeye Name:4-nitro-2-[(1-pentylbenzimidazol-2-yl)iminomethyl]phenolate
CAS Name:4-nitro-2-[(1-pentyl-2-benzimidazolyl)iminomethyl]phenolate
IUPAC Name:4-nitro-2-[(1-pentylbenzimidazol-2-yl)iminomethyl]phenolate
Traditional Name:2-[(1-amylbenzimidazol-2-yl)iminomethyl]-4-nitro-phenolate
Formula: C19H19N4O3-
MolecularWeight: 351.37916
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2N=C1N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]


Isomeric SMILES

CCCCCN1C2=CC=CC=C2N=C1N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]


InChI

InChI=1S/C19H20N4O3/c1-2-3-6-11-22-17-8-5-4-7-16(17)21-19(22)20-13-14-12-15(23(25)26)9-10-18(14)24/h4-5,7-10,12-13,24H,2-3,6,11H2,1H3/p-1


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