[2-[[(1S)-1,2-diphenylethyl]amino]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-[[(1S)-1,2-diphenylethyl]amino]-2-keto-ethyl] ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=O)COC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C2=CC=CC=C2)NC(=O)COC(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H19N3O3/c25-20(15-27-21(26)19-14-22-11-12-23-19)24-18(17-9-5-2-6-10-17)13-16-7-3-1-4-8-16/h1-12,14,18H,13,15H2,(H,24,25)/t18-/m0/s1