6,7-dimethoxy-4-piperazin-1-yl-9H-pyrimido[4,5-b]indole

Systemtic Name: 6,7-dimethoxy-4-piperazin-1-yl-9H-pyrimido[4,5-b]indole Openeye Name: 6,7-dimethoxy-4-piperazin-1-yl-9H-pyrimido[4,5-b]indole CAS Name: 6,7-dimethoxy-4-(1-piperazinyl)-9H-pyrimido[4,5-b]indole IUPAC Name: 6,7-dimethoxy-4-piperazin-1-yl-9H-pyrimido[4,5-b]indole Traditional Name: 6,7-dimethoxy-4-piperazino-9H-pyrimid[4,5-b]indole Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(N2)N=CN=C3N4CCNCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(N2)N=CN=C3N4CCNCC4)OC

InChI

InChI=1S/C16H19N5O2/c1-22-12-7-10-11(8-13(12)23-2)20-15-14(10)16(19-9-18-15)21-5-3-17-4-6-21/h7-9,17H,3-6H2,1-2H3,(H,18,19,20)