methyl 2-[[4-methoxy-3-[3-(4-methyl-1,4-diazepan-1-yl)-2-oxidanyl-propoxy]phenyl]methyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[4-methoxy-3-[3-(4-methyl-1,4-diazepan-1-yl)-2-oxidanyl-propoxy]phenyl]methyl-methyl-amino]ethanoate Openeye Name: methyl 2-[[3-[2-hydroxy-3-(4-methyl-1,4-diazepan-1-yl)propoxy]-4-methoxy-phenyl]methyl-methyl-amino]acetate CAS Name: 2-[[3-[2-hydroxy-3-(4-methyl-1,4-diazepan-1-yl)propoxy]-4-methoxyphenyl]methyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-[2-hydroxy-3-(4-methyl-1,4-diazepan-1-yl)propoxy]-4-methoxyphenyl]methyl-methylamino]acetate Traditional Name: 2-[[3-[2-hydroxy-3-(4-methyl-1,4-diazepan-1-yl)propoxy]-4-methoxy-benzyl]-methyl-amino]acetic acid methyl ester Formula: C21H35N3O5 MolecularWeight: 409.5197

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)CC(COC2=C(C=CC(=C2)CN(C)CC(=O)OC)OC)O

Isomeric SMILES

CN1CCCN(CC1)CC(COC2=C(C=CC(=C2)CN(C)CC(=O)OC)OC)O

InChI

InChI=1S/C21H35N3O5/c1-22-8-5-9-24(11-10-22)14-18(25)16-29-20-12-17(6-7-19(20)27-3)13-23(2)15-21(26)28-4/h6-7,12,18,25H,5,8-11,13-16H2,1-4H3