N-(2-morpholin-4-ium-4-ylethyl)-2-(4-nitrophenyl)quinazolin-4-amine

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-nitrophenyl)quinazolin-4-amine Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-nitrophenyl)quinazolin-4-amine CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2-(4-nitrophenyl)-4-quinazolinamine IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-nitrophenyl)quinazolin-4-amine Traditional Name: 2-morpholin-4-ium-4-ylethyl-[2-(4-nitrophenyl)quinazolin-4-yl]amine Formula: C20H22N5O3+ MolecularWeight: 380.42038

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c26-25(27)16-7-5-15(6-8-16)19-22-18-4-2-1-3-17(18)20(23-19)21-9-10-24-11-13-28-14-12-24/h1-8H,9-14H2,(H,21,22,23)/p+1