[2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate

Systemtic Name: [2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate Openeye Name: [2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-oxo-ethyl] 2-(2-oxo-1,3-benzoxazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzoxazol-3-yl)acetic acid [2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] 2-(2-oxo-1,3-benzoxazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzoxazol-3-yl)acetic acid [2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-keto-ethyl] ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)CN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)CN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C21H19N3O5/c1-15-7-9-16(10-8-15)23(12-4-11-22)19(25)14-28-20(26)13-24-17-5-2-3-6-18(17)29-21(24)27/h2-3,5-10H,4,12-14H2,1H3