[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-2-propenoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]acrylic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C=CC1=CN(C2=CC=CC=C21)CCC#N

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)/C=C/C1=CN(C2=CC=CC=C21)CCC#N

InChI

InChI=1S/C17H17N3O3/c1-12(17(19)22)23-16(21)8-7-13-11-20(10-4-9-18)15-6-3-2-5-14(13)15/h2-3,5-8,11-12H,4,10H2,1H3,(H2,19,22)/b8-7+/t12-/m1/s1