[2-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] (E)-3-(2-methylphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] (E)-3-(2-methylphenyl)prop-2-enoate Openeye Name: [2-oxo-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethyl] (E)-3-(o-tolyl)prop-2-enoate CAS Name: (E)-3-(2-methylphenyl)-2-propenoic acid [2-oxo-2-[[(2R)-2-oxolanyl]methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] (E)-3-(2-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(o-tolyl)acrylic acid [2-keto-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethyl] ester Formula: C17H21NO4 MolecularWeight: 303.35294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)OCC(=O)NCC2CCCO2

Isomeric SMILES

CC1=CC=CC=C1/C=C/C(=O)OCC(=O)NC[C@H]2CCCO2

InChI

InChI=1S/C17H21NO4/c1-13-5-2-3-6-14(13)8-9-17(20)22-12-16(19)18-11-15-7-4-10-21-15/h2-3,5-6,8-9,15H,4,7,10-12H2,1H3,(H,18,19)/b9-8+/t15-/m1/s1