2-[1-(3-azanylpropyl)-6-nitro-indol-3-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one

Systemtic Name: 2-[1-(3-azanylpropyl)-6-nitro-indol-3-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one Openeye Name: 2-[1-(3-aminopropyl)-6-nitro-indol-3-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one CAS Name: 2-[1-(3-aminopropyl)-6-nitro-3-indolyl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one IUPAC Name: 2-[1-(3-aminopropyl)-6-nitroindol-3-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one Traditional Name: 2-[1-(3-aminopropyl)-6-nitro-indol-3-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC3=C(C=C2C1)N=C(C(=O)N3)C4=CN(C5=C4C=CC(=C5)[N+](=O)[O-])CCCN

Isomeric SMILES

C1CC2=CC3=C(C=C2C1)N=C(C(=O)N3)C4=CN(C5=C4C=CC(=C5)[N+](=O)[O-])CCCN

InChI

InChI=1S/C22H21N5O3/c23-7-2-8-26-12-17(16-6-5-15(27(29)30)11-20(16)26)21-22(28)25-19-10-14-4-1-3-13(14)9-18(19)24-21/h5-6,9-12H,1-4,7-8,23H2,(H,25,28)