3-(5-chloranyl-2-methyl-phenyl)-8-methoxy-5-methyl-1-(3-methylbutyl)pyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 3-(5-chloranyl-2-methyl-phenyl)-8-methoxy-5-methyl-1-(3-methylbutyl)pyrimido[5,4-b]indole-2,4-dione Openeye Name: 3-(5-chloro-2-methyl-phenyl)-1-isopentyl-8-methoxy-5-methyl-pyrimido[5,4-b]indole-2,4-dione CAS Name: 3-(5-chloro-2-methylphenyl)-8-methoxy-5-methyl-1-(3-methylbutyl)pyrimido[5,4-b]indole-2,4-dione IUPAC Name: 3-(5-chloro-2-methylphenyl)-8-methoxy-5-methyl-1-(3-methylbutyl)pyrimido[5,4-b]indole-2,4-dione Traditional Name: 3-(5-chloro-2-methyl-phenyl)-1-isoamyl-8-methoxy-5-methyl-pyrimid[5,4-b]indole-2,4-quinone Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=O)C3=C(C4=C(N3C)C=CC(=C4)OC)N(C2=O)CCC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=O)C3=C(C4=C(N3C)C=CC(=C4)OC)N(C2=O)CCC(C)C

InChI

InChI=1S/C24H26ClN3O3/c1-14(2)10-11-27-21-18-13-17(31-5)8-9-19(18)26(4)22(21)23(29)28(24(27)30)20-12-16(25)7-6-15(20)3/h6-9,12-14H,10-11H2,1-5H3