6-azanyl-7-(1,3-benzodioxol-2-yl)-2-butan-2-yl-2-(2,5-diethoxy-3,4-dimethoxy-phenyl)heptanenitrile

Systemtic Name: 6-azanyl-7-(1,3-benzodioxol-2-yl)-2-butan-2-yl-2-(2,5-diethoxy-3,4-dimethoxy-phenyl)heptanenitrile Openeye Name: 6-amino-7-(1,3-benzodioxol-2-yl)-2-(2,5-diethoxy-3,4-dimethoxy-phenyl)-2-sec-butyl-heptanenitrile CAS Name: 6-amino-7-(1,3-benzodioxol-2-yl)-2-butan-2-yl-2-(2,5-diethoxy-3,4-dimethoxyphenyl)heptanenitrile IUPAC Name: 6-amino-7-(1,3-benzodioxol-2-yl)-2-butan-2-yl-2-(2,5-diethoxy-3,4-dimethoxyphenyl)heptanenitrile Traditional Name: 6-amino-7-(1,3-benzodioxol-2-yl)-2-(2,5-diethoxy-3,4-dimethoxy-phenyl)-2-sec-butyl-enanthonitrile Formula: C30H42N2O6 MolecularWeight: 526.66428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CCCC(CC1OC2=CC=CC=C2O1)N)(C#N)C3=CC(=C(C(=C3OCC)OC)OC)OCC

Isomeric SMILES

CCC(C)C(CCCC(CC1OC2=CC=CC=C2O1)N)(C#N)C3=CC(=C(C(=C3OCC)OC)OC)OCC

InChI

InChI=1S/C30H42N2O6/c1-7-20(4)30(19-31,16-12-13-21(32)17-26-37-23-14-10-11-15-24(23)38-26)22-18-25(35-8-2)28(33-5)29(34-6)27(22)36-9-3/h10-11,14-15,18,20-21,26H,7-9,12-13,16-17,32H2,1-6H3