7-[4-(aminomethyl)piperidin-1-yl]-N-[2-(4-chlorophenyl)ethyl]-6-nitro-quinazolin-4-amine

Systemtic Name: 7-[4-(aminomethyl)piperidin-1-yl]-N-[2-(4-chlorophenyl)ethyl]-6-nitro-quinazolin-4-amine Openeye Name: 7-[4-(aminomethyl)-1-piperidyl]-N-[2-(4-chlorophenyl)ethyl]-6-nitro-quinazolin-4-amine CAS Name: 7-[4-(aminomethyl)-1-piperidinyl]-N-[2-(4-chlorophenyl)ethyl]-6-nitro-4-quinazolinamine IUPAC Name: 7-[4-(aminomethyl)piperidin-1-yl]-N-[2-(4-chlorophenyl)ethyl]-6-nitroquinazolin-4-amine Traditional Name: [7-[4-(aminomethyl)piperidino]-6-nitro-quinazolin-4-yl]-[2-(4-chlorophenyl)ethyl]amine Formula: C22H25ClN6O2 MolecularWeight: 440.9259

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CN)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H25ClN6O2/c23-17-3-1-15(2-4-17)5-8-25-22-18-11-21(29(30)31)20(12-19(18)26-14-27-22)28-9-6-16(13-24)7-10-28/h1-4,11-12,14,16H,5-10,13,24H2,(H,25,26,27)