6-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-nitro-pyridin-2-amine

Systemtic Name: 6-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-nitro-pyridin-2-amine Openeye Name: 6-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-nitro-pyridin-2-amine CAS Name: 6-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-nitro-2-pyridinamine IUPAC Name: 6-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-nitropyridin-2-amine Traditional Name: [6-(1-methyl-1,3,4,9-tetrahydro-$b-carbolin-2-yl)-3-nitro-2-pyridyl]amine Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CCN1C3=NC(=C(C=C3)[N+](=O)[O-])N)C4=CC=CC=C4N2

Isomeric SMILES

CC1C2=C(CCN1C3=NC(=C(C=C3)[N+](=O)[O-])N)C4=CC=CC=C4N2

InChI

InChI=1S/C17H17N5O2/c1-10-16-12(11-4-2-3-5-13(11)19-16)8-9-21(10)15-7-6-14(22(23)24)17(18)20-15/h2-7,10,19H,8-9H2,1H3,(H2,18,20)