7-(4-azanylpiperidin-1-yl)-6-nitro-N-(phenylmethyl)quinazolin-4-amine

Systemtic Name: 7-(4-azanylpiperidin-1-yl)-6-nitro-N-(phenylmethyl)quinazolin-4-amine Openeye Name: 7-(4-amino-1-piperidyl)-N-benzyl-6-nitro-quinazolin-4-amine CAS Name: 7-(4-amino-1-piperidinyl)-6-nitro-N-(phenylmethyl)-4-quinazolinamine IUPAC Name: 7-(4-aminopiperidin-1-yl)-N-benzyl-6-nitroquinazolin-4-amine Traditional Name: [7-(4-aminopiperidino)-6-nitro-quinazolin-4-yl]-benzyl-amine Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O2/c21-15-6-8-25(9-7-15)18-11-17-16(10-19(18)26(27)28)20(24-13-23-17)22-12-14-4-2-1-3-5-14/h1-5,10-11,13,15H,6-9,12,21H2,(H,22,23,24)