methyl 3-(oxan-2-yloxy)-2-[[(phenylmethyl)amino]methyl]butanoate

Systemtic Name: methyl 3-(oxan-2-yloxy)-2-[[(phenylmethyl)amino]methyl]butanoate Openeye Name: methyl 2-[(benzylamino)methyl]-3-tetrahydropyran-2-yloxy-butanoate CAS Name: 3-(2-oxanyloxy)-2-[[(phenylmethyl)amino]methyl]butanoic acid methyl ester IUPAC Name: methyl 2-[(benzylamino)methyl]-3-(oxan-2-yloxy)butanoate Traditional Name: 2-[(benzylamino)methyl]-3-tetrahydropyran-2-yloxy-butyric acid methyl ester Formula: C18H27NO4 MolecularWeight: 321.41128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CNCC1=CC=CC=C1)C(=O)OC)OC2CCCCO2

Isomeric SMILES

CC(C(CNCC1=CC=CC=C1)C(=O)OC)OC2CCCCO2

InChI

InChI=1S/C18H27NO4/c1-14(23-17-10-6-7-11-22-17)16(18(20)21-2)13-19-12-15-8-4-3-5-9-15/h3-5,8-9,14,16-17,19H,6-7,10-13H2,1-2H3