2-azanyl-N-[(4-methoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-[(4-methoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[(4-methoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[(4-methoxyphenyl)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[(4-methoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(2-morpholin-4-ium-4-ylethyl)-N-p-anisyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H29N6O3+ MolecularWeight: 461.53616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC[NH+]5CCOCC5)N

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC[NH+]5CCOCC5)N

InChI

InChI=1S/C25H28N6O3/c1-33-18-8-6-17(7-9-18)16-27-25(32)21-22-24(29-20-5-3-2-4-19(20)28-22)31(23(21)26)11-10-30-12-14-34-15-13-30/h2-9H,10-16,26H2,1H3,(H,27,32)/p+1