4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5,8-dimethyl-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5,8-dimethyl-pyrimido[5,4-b]indole Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5,8-dimethyl-pyrimido[5,4-b]indole CAS Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-5,8-dimethylpyrimido[5,4-b]indole IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5,8-dimethylpyrimido[5,4-b]indole Traditional Name: 5,8-dimethyl-4-(4-piperonylpiperazino)pyrimid[5,4-b]indole Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2N=CN=C3N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2N=CN=C3N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)C

InChI

InChI=1S/C24H25N5O2/c1-16-3-5-19-18(11-16)22-23(27(19)2)24(26-14-25-22)29-9-7-28(8-10-29)13-17-4-6-20-21(12-17)31-15-30-20/h3-6,11-12,14H,7-10,13,15H2,1-2H3