molecular hydrogen; N-(3-nitrophenyl)-2-phenyl-quinazolin-4-amine; hydrochloride

Systemtic Name: molecular hydrogen; N-(3-nitrophenyl)-2-phenyl-quinazolin-4-amine; hydrochloride Openeye Name: molecular hydrogen; N-(3-nitrophenyl)-2-phenyl-quinazolin-4-amine; hydrochloride CAS Name: molecular hydrogen; N-(3-nitrophenyl)-2-phenyl-4-quinazolinamine; hydrochloride IUPAC Name: molecular hydrogen; N-(3-nitrophenyl)-2-phenylquinazolin-4-amine; hydrochloride Traditional Name: molecular hydrogen; (3-nitrophenyl)-(2-phenylquinazolin-4-yl)amine; hydrochloride Formula: C20H17ClN4O2 MolecularWeight: 380.82758

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Descriptors Computed from Structure

Canonical SMILES:

[HH].C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC(=CC=C4)[N+](=O)[O-].Cl

Isomeric SMILES

[HH].C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC(=CC=C4)[N+](=O)[O-].Cl

InChI

InChI=1S/C20H14N4O2.ClH.H2/c25-24(26)16-10-6-9-15(13-16)21-20-17-11-4-5-12-18(17)22-19(23-20)14-7-2-1-3-8-14;;/h1-13H,(H,21,22,23);2*1H