2-(1,4-diazepan-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]pyridine-3-carboxamide Openeye Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]pyridine-3-carboxamide CAS Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]pyridine-3-carboxamide Traditional Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]nicotinamide Formula: C20H26N4O3 MolecularWeight: 370.44544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCNC(=O)C2=C(N=CC=C2)N3CCCNCC3

Isomeric SMILES

COC1=CC=C(C=C1)OCCNC(=O)C2=C(N=CC=C2)N3CCCNCC3

InChI

InChI=1S/C20H26N4O3/c1-26-16-5-7-17(8-6-16)27-15-12-23-20(25)18-4-2-10-22-19(18)24-13-3-9-21-11-14-24/h2,4-8,10,21H,3,9,11-15H2,1H3,(H,23,25)