N-(3-chlorophenyl)-9H-pyrimido[4,5-b]indol-4-amine hydrochloride

Systemtic Name: N-(3-chlorophenyl)-9H-pyrimido[4,5-b]indol-4-amine hydrochloride Openeye Name: N-(3-chlorophenyl)-9H-pyrimido[4,5-b]indol-4-amine hydrochloride CAS Name: N-(3-chlorophenyl)-9H-pyrimido[4,5-b]indol-4-amine hydrochloride IUPAC Name: N-(3-chlorophenyl)-9H-pyrimido[4,5-b]indol-4-amine hydrochloride Traditional Name: (3-chlorophenyl)-(9H-pyrimid[4,5-b]indol-4-yl)amine hydrochloride Formula: C16H12Cl2N4 MolecularWeight: 331.19928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)N=CN=C3NC4=CC(=CC=C4)Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)N=CN=C3NC4=CC(=CC=C4)Cl.Cl

InChI

InChI=1S/C16H11ClN4.ClH/c17-10-4-3-5-11(8-10)20-15-14-12-6-1-2-7-13(12)21-16(14)19-9-18-15;/h1-9H,(H2,18,19,20,21);1H