8-methoxy-5-methyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3-(phenylmethyl)pyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 8-methoxy-5-methyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3-(phenylmethyl)pyrimido[5,4-b]indole-2,4-dione Openeye Name: 3-benzyl-8-methoxy-5-methyl-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)pyrimido[5,4-b]indole-2,4-dione CAS Name: 8-methoxy-5-methyl-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-(phenylmethyl)pyrimido[5,4-b]indole-2,4-dione IUPAC Name: 3-benzyl-8-methoxy-5-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimido[5,4-b]indole-2,4-dione Traditional Name: 3-benzyl-1-(2-keto-2-pyrrolidino-ethyl)-8-methoxy-5-methyl-pyrimid[5,4-b]indole-2,4-quinone Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C(=O)N3CC(=O)N4CCCC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C(=O)N3CC(=O)N4CCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O4/c1-26-20-11-10-18(33-2)14-19(20)22-23(26)24(31)29(15-17-8-4-3-5-9-17)25(32)28(22)16-21(30)27-12-6-7-13-27/h3-5,8-11,14H,6-7,12-13,15-16H2,1-2H3