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

Systemtic Name: (2R)-2-(aminomethyl)-3-[4-[2-[2,6-bis(chloranyl)-4-methyl-phenoxy]ethoxy]phenyl]-N-cyclopropyl-N-[[3-(2-methoxyethoxy)-5-(3-methoxypropyl)phenyl]methyl]propanamide Openeye Name: (2R)-2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]phenyl]-N-[[3-(2-methoxyethoxy)-5-(3-methoxypropyl)phenyl]methyl]propanamide CAS Name: (2R)-2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-N-[[3-(2-methoxyethoxy)-5-(3-methoxypropyl)phenyl]methyl]propanamide IUPAC Name: (2R)-2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-N-[[3-(2-methoxyethoxy)-5-(3-methoxypropyl)phenyl]methyl]propanamide Traditional Name: (2R)-2-(aminomethyl)-N-cyclopropyl-3-[4-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]phenyl]-N-[3-(2-methoxyethoxy)-5-(3-methoxypropyl)benzyl]propionamide Formula: C36H46Cl2N2O6 MolecularWeight: 673.66624

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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)OCCOC)C4CC4)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)C[C@H](CN)C(=O)N(CC3=CC(=CC(=C3)CCCOC)OCCOC)C4CC4)Cl

InChI

InChI=1S/C36H46Cl2N2O6/c1-25-17-33(37)35(34(38)18-25)46-16-15-44-31-10-6-26(7-11-31)20-29(23-39)36(41)40(30-8-9-30)24-28-19-27(5-4-12-42-2)21-32(22-28)45-14-13-43-3/h6-7,10-11,17-19,21-22,29-30H,4-5,8-9,12-16,20,23-24,39H2,1-3H3/t29-/m1/s1