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

Systemtic Name: 7-[4-(aminomethyl)piperidin-1-yl]-6-nitro-N-phenethyl-quinazolin-4-amine Openeye Name: 7-[4-(aminomethyl)-1-piperidyl]-6-nitro-N-phenethyl-quinazolin-4-amine CAS Name: 7-[4-(aminomethyl)-1-piperidinyl]-6-nitro-N-phenethyl-4-quinazolinamine IUPAC Name: 7-[4-(aminomethyl)piperidin-1-yl]-6-nitro-N-phenethylquinazolin-4-amine Traditional Name: [7-[4-(aminomethyl)piperidino]-6-nitro-quinazolin-4-yl]-phenethyl-amine Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N6O2/c23-14-17-7-10-27(11-8-17)20-13-19-18(12-21(20)28(29)30)22(26-15-25-19)24-9-6-16-4-2-1-3-5-16/h1-5,12-13,15,17H,6-11,14,23H2,(H,24,25,26)