[6-(7-chloranylquinolin-2-yl)-5,7-dihydropyrrolo[3,4-b]pyrazin-5-yl] 4-prop-2-enoylpiperazine-1-carboxylate

Systemtic Name: [6-(7-chloranylquinolin-2-yl)-5,7-dihydropyrrolo[3,4-b]pyrazin-5-yl] 4-prop-2-enoylpiperazine-1-carboxylate Openeye Name: [6-(7-chloro-2-quinolyl)-5,7-dihydropyrrolo[3,4-b]pyrazin-5-yl] 4-prop-2-enoylpiperazine-1-carboxylate CAS Name: 4-(1-oxoprop-2-enyl)-1-piperazinecarboxylic acid [6-(7-chloro-2-quinolinyl)-5,7-dihydropyrrolo[3,4-b]pyrazin-5-yl] ester IUPAC Name: [6-(7-chloroquinolin-2-yl)-5,7-dihydropyrrolo[3,4-b]pyrazin-5-yl] 4-prop-2-enoylpiperazine-1-carboxylate Traditional Name: 4-acryloylpiperazine-1-carboxylic acid [6-(7-chloro-2-quinolyl)-5,7-dihydropyrrolo[3,4-b]pyrazin-5-yl] ester Formula: C23H21ClN6O3 MolecularWeight: 464.90424

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)N1CCN(CC1)C(=O)OC2C3=NC=CN=C3CN2C4=NC5=C(C=CC(=C5)Cl)C=C4

Isomeric SMILES

C=CC(=O)N1CCN(CC1)C(=O)OC2C3=NC=CN=C3CN2C4=NC5=C(C=CC(=C5)Cl)C=C4

InChI

InChI=1S/C23H21ClN6O3/c1-2-20(31)28-9-11-29(12-10-28)23(32)33-22-21-18(25-7-8-26-21)14-30(22)19-6-4-15-3-5-16(24)13-17(15)27-19/h2-8,13,22H,1,9-12,14H2