methyl N-[4-[2-oxidanyl-3-[(phenylmethyl)amino]propoxy]phenyl]carbamate

Systemtic Name: methyl N-[4-[2-oxidanyl-3-[(phenylmethyl)amino]propoxy]phenyl]carbamate Openeye Name: methyl N-[4-[3-(benzylamino)-2-hydroxy-propoxy]phenyl]carbamate CAS Name: N-[4-[2-hydroxy-3-[(phenylmethyl)amino]propoxy]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[3-(benzylamino)-2-hydroxypropoxy]phenyl]carbamate Traditional Name: N-[4-[3-(benzylamino)-2-hydroxy-propoxy]phenyl]carbamic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)OCC(CNCC2=CC=CC=C2)O

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)OCC(CNCC2=CC=CC=C2)O

InChI

InChI=1S/C18H22N2O4/c1-23-18(22)20-15-7-9-17(10-8-15)24-13-16(21)12-19-11-14-5-3-2-4-6-14/h2-10,16,19,21H,11-13H2,1H3,(H,20,22)