2-(aminomethyl)-3-[4-[2-[2,6-bis(chloranyl)-4-methyl-phenoxy]ethoxy]phenyl]-N-cyclopropyl-N-[[3-(3-methoxypropyl)-5-(2-pyridin-2-ylethoxy)phenyl]methyl]propanamide

Systemtic Name: 2-(aminomethyl)-3-[4-[2-[2,6-bis(chloranyl)-4-methyl-phenoxy]ethoxy]phenyl]-N-cyclopropyl-N-[[3-(3-methoxypropyl)-5-(2-pyridin-2-ylethoxy)phenyl]methyl]propanamide Openeye Name: 2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]phenyl]-N-[[3-(3-methoxypropyl)-5-[2-(2-pyridyl)ethoxy]phenyl]methyl]propanamide CAS Name: 2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-N-[[3-(3-methoxypropyl)-5-[2-(2-pyridinyl)ethoxy]phenyl]methyl]propanamide IUPAC Name: 2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-N-[[3-(3-methoxypropyl)-5-(2-pyridin-2-ylethoxy)phenyl]methyl]propanamide Traditional Name: 2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]phenyl]-N-[3-(3-methoxypropyl)-5-[2-(2-pyridyl)ethoxy]benzyl]propionamide Formula: C40H47Cl2N3O5 MolecularWeight: 720.72428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)CC(CN)C(=O)N(CC3=CC(=CC(=C3)CCCOC)OCCC4=CC=CC=N4)C5CC5)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)CC(CN)C(=O)N(CC3=CC(=CC(=C3)CCCOC)OCCC4=CC=CC=N4)C5CC5)Cl

InChI

InChI=1S/C40H47Cl2N3O5/c1-28-20-37(41)39(38(42)21-28)50-19-18-49-35-12-8-29(9-13-35)23-32(26-43)40(46)45(34-10-11-34)27-31-22-30(6-5-16-47-2)24-36(25-31)48-17-14-33-7-3-4-15-44-33/h3-4,7-9,12-13,15,20-22,24-25,32,34H,5-6,10-11,14,16-19,23,26-27,43H2,1-2H3