N-(3-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-(3-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-(3-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-(3-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-(3-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (3-nitrophenyl)-(5H-pyrimid[5,4-b]indol-4-yl)amine Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)C(=NC=N3)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)C(=NC=N3)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N5O2/c22-21(23)11-5-3-4-10(8-11)19-16-15-14(17-9-18-16)12-6-1-2-7-13(12)20-15/h1-9,20H,(H,17,18,19)