N-(1,3-benzodioxol-4-ylmethyl)-N-(pyridin-3-ylmethyl)cycloheptanecarboxamide

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(pyridin-3-ylmethyl)cycloheptanecarboxamide Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(3-pyridylmethyl)cycloheptanecarboxamide CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(3-pyridinylmethyl)cycloheptanecarboxamide IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(pyridin-3-ylmethyl)cycloheptanecarboxamide Traditional Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(3-pyridylmethyl)cycloheptanecarboxamide Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)N(CC2=CN=CC=C2)CC3=C4C(=CC=C3)OCO4

Isomeric SMILES

C1CCCC(CC1)C(=O)N(CC2=CN=CC=C2)CC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C22H26N2O3/c25-22(18-8-3-1-2-4-9-18)24(14-17-7-6-12-23-13-17)15-19-10-5-11-20-21(19)27-16-26-20/h5-7,10-13,18H,1-4,8-9,14-16H2