(2R)-1-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]-3-pyrrolidin-1-yl-propan-2-ol

Systemtic Name: (2R)-1-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]-3-pyrrolidin-1-yl-propan-2-ol Openeye Name: (2R)-1-[4-[(allylamino)methyl]-2-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol CAS Name: (2R)-1-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]-3-(1-pyrrolidinyl)-2-propanol IUPAC Name: (2R)-1-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol Traditional Name: (2R)-1-[4-[(allylamino)methyl]-2-methoxy-phenoxy]-3-pyrrolidino-propan-2-ol Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC=C)OCC(CN2CCCC2)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC=C)OC[C@@H](CN2CCCC2)O

InChI

InChI=1S/C18H28N2O3/c1-3-8-19-12-15-6-7-17(18(11-15)22-2)23-14-16(21)13-20-9-4-5-10-20/h3,6-7,11,16,19,21H,1,4-5,8-10,12-14H2,2H3/t16-/m1/s1