methyl 1-(3-azanylpropyl)-3-[6,7-bis(chloranyl)-4-methyl-3-oxidanylidene-quinoxalin-2-yl]indole-5-carboxylate

Systemtic Name: methyl 1-(3-azanylpropyl)-3-[6,7-bis(chloranyl)-4-methyl-3-oxidanylidene-quinoxalin-2-yl]indole-5-carboxylate Openeye Name: methyl 1-(3-aminopropyl)-3-(6,7-dichloro-4-methyl-3-oxo-quinoxalin-2-yl)indole-5-carboxylate CAS Name: 1-(3-aminopropyl)-3-(6,7-dichloro-4-methyl-3-oxo-2-quinoxalinyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-aminopropyl)-3-(6,7-dichloro-4-methyl-3-oxoquinoxalin-2-yl)indole-5-carboxylate Traditional Name: 1-(3-aminopropyl)-3-(6,7-dichloro-3-keto-4-methyl-quinoxalin-2-yl)indole-5-carboxylic acid methyl ester Formula: C22H20Cl2N4O3 MolecularWeight: 459.3252

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N=C(C1=O)C3=CN(C4=C3C=C(C=C4)C(=O)OC)CCCN)Cl)Cl

Isomeric SMILES

CN1C2=CC(=C(C=C2N=C(C1=O)C3=CN(C4=C3C=C(C=C4)C(=O)OC)CCCN)Cl)Cl

InChI

InChI=1S/C22H20Cl2N4O3/c1-27-19-10-16(24)15(23)9-17(19)26-20(21(27)29)14-11-28(7-3-6-25)18-5-4-12(8-13(14)18)22(30)31-2/h4-5,8-11H,3,6-7,25H2,1-2H3