2,5-dimethyl-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)pyrrole-3-carbaldehyde

Systemtic Name: 2,5-dimethyl-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)pyrrole-3-carbaldehyde Openeye Name: 2,5-dimethyl-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)pyrrole-3-carbaldehyde CAS Name: 2,5-dimethyl-1-[3-nitro-4-(1-pyrrolidinyl)phenyl]-3-pyrrolecarboxaldehyde IUPAC Name: 2,5-dimethyl-1-(3-nitro-4-pyrrolidin-1-ylphenyl)pyrrole-3-carbaldehyde Traditional Name: 2,5-dimethyl-1-(3-nitro-4-pyrrolidino-phenyl)pyrrole-3-carbaldehyde Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C)C=O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C)C=O

InChI

InChI=1S/C17H19N3O3/c1-12-9-14(11-21)13(2)19(12)15-5-6-16(17(10-15)20(22)23)18-7-3-4-8-18/h5-6,9-11H,3-4,7-8H2,1-2H3