2-(2,5-diethoxy-3,4-dimethoxy-phenyl)-7-(3,4-dimethoxyphenyl)-6-nitro-2-pentan-3-yl-heptanenitrile

Systemtic Name: 2-(2,5-diethoxy-3,4-dimethoxy-phenyl)-7-(3,4-dimethoxyphenyl)-6-nitro-2-pentan-3-yl-heptanenitrile Openeye Name: 2-(2,5-diethoxy-3,4-dimethoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-(1-ethylpropyl)-6-nitro-heptanenitrile CAS Name: 2-(2,5-diethoxy-3,4-dimethoxyphenyl)-7-(3,4-dimethoxyphenyl)-6-nitro-2-pentan-3-ylheptanenitrile IUPAC Name: 2-(2,5-diethoxy-3,4-dimethoxyphenyl)-7-(3,4-dimethoxyphenyl)-6-nitro-2-pentan-3-ylheptanenitrile Traditional Name: 2-(2,5-diethoxy-3,4-dimethoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-(1-ethylpropyl)-6-nitro-enanthonitrile Formula: C32H46N2O8 MolecularWeight: 586.71624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CCCC(CC1=CC(=C(C=C1)OC)OC)[N+](=O)[O-])(C#N)C2=CC(=C(C(=C2OCC)OC)OC)OCC

Isomeric SMILES

CCC(CC)C(CCCC(CC1=CC(=C(C=C1)OC)OC)[N+](=O)[O-])(C#N)C2=CC(=C(C(=C2OCC)OC)OC)OCC

InChI

InChI=1S/C32H46N2O8/c1-9-23(10-2)32(21-33,25-20-28(41-11-3)30(39-7)31(40-8)29(25)42-12-4)17-13-14-24(34(35)36)18-22-15-16-26(37-5)27(19-22)38-6/h15-16,19-20,23-24H,9-14,17-18H2,1-8H3