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

Systemtic Name: ethyl 2-[[4-[3-(azocan-1-yl)-2-oxidanyl-propoxy]-3-methoxy-phenyl]methyl-methyl-amino]ethanoate Openeye Name: ethyl 2-[[4-[3-(azocan-1-yl)-2-hydroxy-propoxy]-3-methoxy-phenyl]methyl-methyl-amino]acetate CAS Name: 2-[[4-[3-(1-azocanyl)-2-hydroxypropoxy]-3-methoxyphenyl]methyl-methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-[3-(azocan-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl]methyl-methylamino]acetate Traditional Name: 2-[[4-[3-(azocan-1-yl)-2-hydroxy-propoxy]-3-methoxy-benzyl]-methyl-amino]acetic acid ethyl ester Formula: C23H38N2O5 MolecularWeight: 422.55822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)CC1=CC(=C(C=C1)OCC(CN2CCCCCCC2)O)OC

Isomeric SMILES

CCOC(=O)CN(C)CC1=CC(=C(C=C1)OCC(CN2CCCCCCC2)O)OC

InChI

InChI=1S/C23H38N2O5/c1-4-29-23(27)17-24(2)15-19-10-11-21(22(14-19)28-3)30-18-20(26)16-25-12-8-6-5-7-9-13-25/h10-11,14,20,26H,4-9,12-13,15-18H2,1-3H3