7-chloranyl-9-methyl-2-phenyl-pyrimido[4,5-b]indole-4-carboxylic acid

Systemtic Name: 7-chloranyl-9-methyl-2-phenyl-pyrimido[4,5-b]indole-4-carboxylic acid Openeye Name: 7-chloro-9-methyl-2-phenyl-pyrimido[4,5-b]indole-4-carboxylic acid CAS Name: 7-chloro-9-methyl-2-phenyl-4-pyrimido[4,5-b]indolecarboxylic acid IUPAC Name: 7-chloro-9-methyl-2-phenylpyrimido[4,5-b]indole-4-carboxylic acid Traditional Name: 7-chloro-9-methyl-2-phenyl-pyrimid[4,5-b]indole-4-carboxylic acid Formula: C18H12ClN3O2 MolecularWeight: 337.75978

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)Cl)C3=C(N=C(N=C31)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CN1C2=C(C=CC(=C2)Cl)C3=C(N=C(N=C31)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C18H12ClN3O2/c1-22-13-9-11(19)7-8-12(13)14-15(18(23)24)20-16(21-17(14)22)10-5-3-2-4-6-10/h2-9H,1H3,(H,23,24)