6-azanyl-7-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-yl-2-(2,3,4-trimethoxyphenyl)heptanenitrile

Systemtic Name: 6-azanyl-7-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-yl-2-(2,3,4-trimethoxyphenyl)heptanenitrile Openeye Name: 6-amino-7-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-isopropyl-2-(2,3,4-trimethoxyphenyl)heptanenitrile CAS Name: 6-amino-7-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-yl-2-(2,3,4-trimethoxyphenyl)heptanenitrile IUPAC Name: 6-amino-7-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-propan-2-yl-2-(2,3,4-trimethoxyphenyl)heptanenitrile Traditional Name: 6-amino-7-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-isopropyl-2-(2,3,4-trimethoxyphenyl)enanthonitrile Formula: C27H36N2O5 MolecularWeight: 468.58514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(CC1COC2=CC=CC=C2O1)N)(C#N)C3=C(C(=C(C=C3)OC)OC)OC

Isomeric SMILES

CC(C)C(CCCC(CC1COC2=CC=CC=C2O1)N)(C#N)C3=C(C(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C27H36N2O5/c1-18(2)27(17-28,21-12-13-24(30-3)26(32-5)25(21)31-4)14-8-9-19(29)15-20-16-33-22-10-6-7-11-23(22)34-20/h6-7,10-13,18-20H,8-9,14-16,29H2,1-5H3