[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O3/c26-21(16-28-22(27)20-15-23-13-14-24-20)25-12-11-19(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,13-15,19H,11-12,16H2,(H,25,26)