8-methoxy-5-methyl-3-phenethyl-1-(phenylmethyl)pyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 8-methoxy-5-methyl-3-phenethyl-1-(phenylmethyl)pyrimido[5,4-b]indole-2,4-dione Openeye Name: 1-benzyl-8-methoxy-5-methyl-3-phenethyl-pyrimido[5,4-b]indole-2,4-dione CAS Name: 8-methoxy-5-methyl-3-phenethyl-1-(phenylmethyl)pyrimido[5,4-b]indole-2,4-dione IUPAC Name: 1-benzyl-8-methoxy-5-methyl-3-phenethylpyrimido[5,4-b]indole-2,4-dione Traditional Name: 1-benzyl-8-methoxy-5-methyl-3-phenethyl-pyrimid[5,4-b]indole-2,4-quinone Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C(=O)N3CC4=CC=CC=C4)CCC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C(=O)N3CC4=CC=CC=C4)CCC5=CC=CC=C5

InChI

InChI=1S/C27H25N3O3/c1-28-23-14-13-21(33-2)17-22(23)24-25(28)26(31)29(16-15-19-9-5-3-6-10-19)27(32)30(24)18-20-11-7-4-8-12-20/h3-14,17H,15-16,18H2,1-2H3