methyl 1-(3-azanylpropyl)-3-(5-methyl-3-oxidanylidene-4H-quinoxalin-2-yl)indole-5-carboxylate

Systemtic Name: methyl 1-(3-azanylpropyl)-3-(5-methyl-3-oxidanylidene-4H-quinoxalin-2-yl)indole-5-carboxylate Openeye Name: methyl 1-(3-aminopropyl)-3-(5-methyl-3-oxo-4H-quinoxalin-2-yl)indole-5-carboxylate CAS Name: 1-(3-aminopropyl)-3-(5-methyl-3-oxo-4H-quinoxalin-2-yl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-aminopropyl)-3-(5-methyl-3-oxo-4H-quinoxalin-2-yl)indole-5-carboxylate Traditional Name: 1-(3-aminopropyl)-3-(3-keto-5-methyl-4H-quinoxalin-2-yl)indole-5-carboxylic acid methyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(C(=O)N2)C3=CN(C4=C3C=C(C=C4)C(=O)OC)CCCN

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(C(=O)N2)C3=CN(C4=C3C=C(C=C4)C(=O)OC)CCCN

InChI

InChI=1S/C22H22N4O3/c1-13-5-3-6-17-19(13)25-21(27)20(24-17)16-12-26(10-4-9-23)18-8-7-14(11-15(16)18)22(28)29-2/h3,5-8,11-12H,4,9-10,23H2,1-2H3,(H,25,27)