2-azanyl-N-(3-methoxypropyl)-1-(4-nitrophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(3-methoxypropyl)-1-(4-nitrophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(3-methoxypropyl)-1-(4-nitrophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(3-methoxypropyl)-1-(4-nitrophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(3-methoxypropyl)-1-(4-nitrophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(3-methoxypropyl)-1-(4-nitrophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C21H20N6O4 MolecularWeight: 420.4213

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

COCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)[N+](=O)[O-])N

InChI

InChI=1S/C21H20N6O4/c1-31-12-4-11-23-21(28)17-18-20(25-16-6-3-2-5-15(16)24-18)26(19(17)22)13-7-9-14(10-8-13)27(29)30/h2-3,5-10H,4,11-12,22H2,1H3,(H,23,28)