[3-(prop-2-enoxycarbonylamino)phenyl] N-(2-cyanoethyl)-N-(3-methoxyphenyl)carbamate

Systemtic Name: [3-(prop-2-enoxycarbonylamino)phenyl] N-(2-cyanoethyl)-N-(3-methoxyphenyl)carbamate Openeye Name: [3-(allyloxycarbonylamino)phenyl] N-(2-cyanoethyl)-N-(3-methoxyphenyl)carbamate CAS Name: N-(2-cyanoethyl)-N-(3-methoxyphenyl)carbamic acid [3-[[oxo(prop-2-enoxy)methyl]amino]phenyl] ester IUPAC Name: [3-(prop-2-enoxycarbonylamino)phenyl] N-(2-cyanoethyl)-N-(3-methoxyphenyl)carbamate Traditional Name: N-(2-cyanoethyl)-N-(3-methoxyphenyl)carbamic acid [3-(allyloxycarbonylamino)phenyl] ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CCC#N)C(=O)OC2=CC=CC(=C2)NC(=O)OCC=C

Isomeric SMILES

COC1=CC=CC(=C1)N(CCC#N)C(=O)OC2=CC=CC(=C2)NC(=O)OCC=C

InChI

InChI=1S/C21H21N3O5/c1-3-13-28-20(25)23-16-7-4-10-19(14-16)29-21(26)24(12-6-11-22)17-8-5-9-18(15-17)27-2/h3-5,7-10,14-15H,1,6,12-13H2,2H3,(H,23,25)