2-(3,4-dimethoxyphenyl)-6-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-7-oxidanyl-2-propan-2-yl-heptanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-6-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-7-oxidanyl-2-propan-2-yl-heptanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-6-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-7-hydroxy-2-isopropyl-heptanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-6-[(3,4-dimethoxyphenyl)methyl-methylamino]-7-hydroxy-2-propan-2-ylheptanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-6-[(3,4-dimethoxyphenyl)methyl-methylamino]-7-hydroxy-2-propan-2-ylheptanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-7-hydroxy-2-isopropyl-6-[methyl(veratryl)amino]enanthonitrile Formula: C28H40N2O5 MolecularWeight: 484.6276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(CO)N(C)CC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)C(CCCC(CO)N(C)CC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-11-13-25(33-5)27(16-22)35-7)14-8-9-23(18-31)30(3)17-21-10-12-24(32-4)26(15-21)34-6/h10-13,15-16,20,23,31H,8-9,14,17-18H2,1-7H3