2-(3-methoxy-4-methyl-2-nitro-6-pyrrolidin-1-yl-phenyl)ethanenitrile

Systemtic Name: 2-(3-methoxy-4-methyl-2-nitro-6-pyrrolidin-1-yl-phenyl)ethanenitrile Openeye Name: 2-(3-methoxy-4-methyl-2-nitro-6-pyrrolidin-1-yl-phenyl)acetonitrile CAS Name: 2-[3-methoxy-4-methyl-2-nitro-6-(1-pyrrolidinyl)phenyl]acetonitrile IUPAC Name: 2-(3-methoxy-4-methyl-2-nitro-6-pyrrolidin-1-ylphenyl)acetonitrile Traditional Name: 2-(3-methoxy-4-methyl-2-nitro-6-pyrrolidino-phenyl)acetonitrile Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC)[N+](=O)[O-])CC#N)N2CCCC2

Isomeric SMILES

CC1=CC(=C(C(=C1OC)[N+](=O)[O-])CC#N)N2CCCC2

InChI

InChI=1S/C14H17N3O3/c1-10-9-12(16-7-3-4-8-16)11(5-6-15)13(17(18)19)14(10)20-2/h9H,3-5,7-8H2,1-2H3