2,5-dimethyl-1-(3-nitro-4-propan-2-yloxy-phenyl)pyrrole-3-carbaldehyde

Systemtic Name: 2,5-dimethyl-1-(3-nitro-4-propan-2-yloxy-phenyl)pyrrole-3-carbaldehyde Openeye Name: 1-(4-isopropoxy-3-nitro-phenyl)-2,5-dimethyl-pyrrole-3-carbaldehyde CAS Name: 2,5-dimethyl-1-(3-nitro-4-propan-2-yloxyphenyl)-3-pyrrolecarboxaldehyde IUPAC Name: 2,5-dimethyl-1-(3-nitro-4-propan-2-yloxyphenyl)pyrrole-3-carbaldehyde Traditional Name: 1-(4-isopropoxy-3-nitro-phenyl)-2,5-dimethyl-pyrrole-3-carbaldehyde Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-10(2)22-16-6-5-14(8-15(16)18(20)21)17-11(3)7-13(9-19)12(17)4/h5-10H,1-4H3