8-methoxy-4-[(3R)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 8-methoxy-4-[(3R)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 8-methoxy-4-[(3R)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 8-methoxy-4-[(3R)-4-(3-methoxyphenyl)-3-methyl-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 8-methoxy-4-[(3R)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 8-methoxy-4-[(3R)-4-(3-methoxyphenyl)-3-methyl-piperazino]-5H-pyrimid[5,4-b]indole Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC(=CC=C2)OC)C3=NC=NC4=C3NC5=C4C=C(C=C5)OC

Isomeric SMILES

C[C@@H]1CN(CCN1C2=CC(=CC=C2)OC)C3=NC=NC4=C3NC5=C4C=C(C=C5)OC

InChI

InChI=1S/C23H25N5O2/c1-15-13-27(9-10-28(15)16-5-4-6-17(11-16)29-2)23-22-21(24-14-25-23)19-12-18(30-3)7-8-20(19)26-22/h4-8,11-12,14-15,26H,9-10,13H2,1-3H3/t15-/m1/s1