9-methyl-4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 9-methyl-4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 9-methyl-4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 9-methyl-4-[4-(4-nitrophenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 9-methyl-4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 9-methyl-4-[4-(4-nitrophenyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC3=C2N=CN=C3N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)NC3=C2N=CN=C3N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O2/c1-14-3-2-4-17-18(14)19-20(24-17)21(23-13-22-19)26-11-9-25(10-12-26)15-5-7-16(8-6-15)27(28)29/h2-8,13,24H,9-12H2,1H3