5-nitro-2-(1-oxidanylpropan-2-ylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(1-oxidanylpropan-2-ylamino)benzenecarbonitrile Openeye Name: 2-[(2-hydroxy-1-methyl-ethyl)amino]-5-nitro-benzonitrile CAS Name: 2-(1-hydroxypropan-2-ylamino)-5-nitrobenzonitrile IUPAC Name: 2-(1-hydroxypropan-2-ylamino)-5-nitrobenzonitrile Traditional Name: 2-[(2-hydroxy-1-methyl-ethyl)amino]-5-nitro-benzonitrile Formula: C10H11N3O3 MolecularWeight: 221.21264

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CC(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C10H11N3O3/c1-7(6-14)12-10-3-2-9(13(15)16)4-8(10)5-11/h2-4,7,12,14H,6H2,1H3