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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)CC1=CC(=C(C=C1)OC)OCC(CN2CCN(CC2)C)O

Isomeric SMILES

CCOC(=O)CN(C)CC1=CC(=C(C=C1)OC)OCC(CN2CCN(CC2)C)O

InChI

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