1-(azepan-1-yl)-3-[4-chloranyl-2-[(prop-2-enylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[4-chloranyl-2-[(prop-2-enylamino)methyl]phenoxy]propan-2-ol Openeye Name: 1-[2-[(allylamino)methyl]-4-chloro-phenoxy]-3-(azepan-1-yl)propan-2-ol CAS Name: 1-(1-azepanyl)-3-[4-chloro-2-[(prop-2-enylamino)methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[4-chloro-2-[(prop-2-enylamino)methyl]phenoxy]propan-2-ol Traditional Name: 1-[2-[(allylamino)methyl]-4-chloro-phenoxy]-3-(azepan-1-yl)propan-2-ol Formula: C19H29ClN2O2 MolecularWeight: 352.89876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNCC1=C(C=CC(=C1)Cl)OCC(CN2CCCCCC2)O

Isomeric SMILES

C=CCNCC1=C(C=CC(=C1)Cl)OCC(CN2CCCCCC2)O

InChI

InChI=1S/C19H29ClN2O2/c1-2-9-21-13-16-12-17(20)7-8-19(16)24-15-18(23)14-22-10-5-3-4-6-11-22/h2,7-8,12,18,21,23H,1,3-6,9-11,13-15H2