ethanoic acid; methyl 1-(3-azanylpropyl)-3-(2-oxidanylidene-1H-benzo[g]quinoxalin-3-yl)indole-5-carboxylate

Systemtic Name: ethanoic acid; methyl 1-(3-azanylpropyl)-3-(2-oxidanylidene-1H-benzo[g]quinoxalin-3-yl)indole-5-carboxylate Openeye Name: acetic acid; methyl 1-(3-aminopropyl)-3-(2-oxo-1H-benzo[g]quinoxalin-3-yl)indole-5-carboxylate CAS Name: acetic acid; 1-(3-aminopropyl)-3-(2-oxo-1H-benzo[g]quinoxalin-3-yl)-5-indolecarboxylic acid methyl ester IUPAC Name: acetic acid; methyl 1-(3-aminopropyl)-3-(2-oxo-1H-benzo[g]quinoxalin-3-yl)indole-5-carboxylate Traditional Name: acetic acid; 1-(3-aminopropyl)-3-(2-keto-1H-benzo[g]quinoxalin-3-yl)indole-5-carboxylic acid methyl ester Formula: C27H26N4O5 MolecularWeight: 486.51914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC(=O)C1=CC2=C(C=C1)N(C=C2C3=NC4=CC5=CC=CC=C5C=C4NC3=O)CCCN

Isomeric SMILES

CC(=O)O.COC(=O)C1=CC2=C(C=C1)N(C=C2C3=NC4=CC5=CC=CC=C5C=C4NC3=O)CCCN

InChI

InChI=1S/C25H22N4O3.C2H4O2/c1-32-25(31)17-7-8-22-18(11-17)19(14-29(22)10-4-9-26)23-24(30)28-21-13-16-6-3-2-5-15(16)12-20(21)27-23;1-2(3)4/h2-3,5-8,11-14H,4,9-10,26H2,1H3,(H,28,30);1H3,(H,3,4)