4-methoxy-2-nitro-N-propan-2-yl-aniline; 6-methoxy-3-propan-2-yl-1H-benzimidazol-2-one

Systemtic Name: 4-methoxy-2-nitro-N-propan-2-yl-aniline; 6-methoxy-3-propan-2-yl-1H-benzimidazol-2-one Openeye Name: 3-isopropyl-6-methoxy-1H-benzimidazol-2-one; N-isopropyl-4-methoxy-2-nitro-aniline CAS Name: 4-methoxy-2-nitro-N-propan-2-ylaniline; 6-methoxy-3-propan-2-yl-1H-benzimidazol-2-one IUPAC Name: 4-methoxy-2-nitro-N-propan-2-ylaniline; 6-methoxy-3-propan-2-yl-1H-benzimidazol-2-one Traditional Name: 3-isopropyl-6-methoxy-1H-benzimidazol-2-one; isopropyl-(4-methoxy-2-nitro-phenyl)amine Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C=C(C=C1)OC)[N+](=O)[O-].CC(C)N1C2=C(C=C(C=C2)OC)NC1=O

Isomeric SMILES

CC(C)NC1=C(C=C(C=C1)OC)[N+](=O)[O-].CC(C)N1C2=C(C=C(C=C2)OC)NC1=O

InChI

InChI=1S/C11H14N2O2.C10H14N2O3/c1-7(2)13-10-5-4-8(15-3)6-9(10)12-11(13)14;1-7(2)11-9-5-4-8(15-3)6-10(9)12(13)14/h4-7H,1-3H3,(H,12,14);4-7,11H,1-3H3