2-(aminomethyl)-3-[4-[2-[2,6-bis(chloranyl)-4-methyl-phenoxy]ethoxy]phenyl]-1-(3-methoxypiperidin-1-yl)propan-1-one

Systemtic Name: 2-(aminomethyl)-3-[4-[2-[2,6-bis(chloranyl)-4-methyl-phenoxy]ethoxy]phenyl]-1-(3-methoxypiperidin-1-yl)propan-1-one Openeye Name: 2-(aminomethyl)-3-[4-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]phenyl]-1-(3-methoxy-1-piperidyl)propan-1-one CAS Name: 2-(aminomethyl)-3-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-1-(3-methoxy-1-piperidinyl)-1-propanone IUPAC Name: 2-(aminomethyl)-3-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-1-(3-methoxypiperidin-1-yl)propan-1-one Traditional Name: 2-(aminomethyl)-3-[4-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]phenyl]-1-(3-methoxypiperidino)propan-1-one Formula: C25H32Cl2N2O4 MolecularWeight: 495.43858

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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)N3CCCC(C3)OC)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)CC(CN)C(=O)N3CCCC(C3)OC)Cl

InChI

InChI=1S/C25H32Cl2N2O4/c1-17-12-22(26)24(23(27)13-17)33-11-10-32-20-7-5-18(6-8-20)14-19(15-28)25(30)29-9-3-4-21(16-29)31-2/h5-8,12-13,19,21H,3-4,9-11,14-16,28H2,1-2H3