1-[4-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol

Systemtic Name: 1-[4-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol Openeye Name: 1-[4-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol CAS Name: 1-[4-(1-azepanylmethyl)-2-methoxyphenoxy]-3-(1-pyrrolidinyl)-2-propanol IUPAC Name: 1-[4-(azepan-1-ylmethyl)-2-methoxyphenoxy]-3-pyrrolidin-1-ylpropan-2-ol Traditional Name: 1-[4-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-pyrrolidino-propan-2-ol Formula: C21H34N2O3 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCCCCC2)OCC(CN3CCCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCCCCC2)OCC(CN3CCCC3)O

InChI

InChI=1S/C21H34N2O3/c1-25-21-14-18(15-22-10-4-2-3-5-11-22)8-9-20(21)26-17-19(24)16-23-12-6-7-13-23/h8-9,14,19,24H,2-7,10-13,15-17H2,1H3