5-(4-chlorophenyl)-2-[2-[3-nitro-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]pyridine

Systemtic Name: 5-(4-chlorophenyl)-2-[2-[3-nitro-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]pyridine Openeye Name: 5-(4-chlorophenyl)-2-[2-[3-nitro-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]pyridine CAS Name: 5-(4-chlorophenyl)-2-[2-[3-nitro-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]ethynyl]pyridine IUPAC Name: 5-(4-chlorophenyl)-2-[2-[3-nitro-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]pyridine Traditional Name: 5-(4-chlorophenyl)-2-[2-[3-nitro-4-(2-pyrrolidinoethoxy)phenyl]ethynyl]pyridine Formula: C25H22ClN3O3 MolecularWeight: 447.91348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=C(C=C(C=C2)C#CC3=NC=C(C=C3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CCOC2=C(C=C(C=C2)C#CC3=NC=C(C=C3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H22ClN3O3/c26-22-8-5-20(6-9-22)21-7-11-23(27-18-21)10-3-19-4-12-25(24(17-19)29(30)31)32-16-15-28-13-1-2-14-28/h4-9,11-12,17-18H,1-2,13-16H2