N-(1,3-benzodioxol-5-ylmethyl)-6-nitro-7-piperazin-1-yl-N-propyl-quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-nitro-7-piperazin-1-yl-N-propyl-quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-nitro-7-piperazin-1-yl-N-propyl-quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-nitro-7-(1-piperazinyl)-N-propyl-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-nitro-7-piperazin-1-yl-N-propylquinazolin-4-amine Traditional Name: (6-nitro-7-piperazino-quinazolin-4-yl)-piperonyl-propyl-amine Formula: C23H26N6O4 MolecularWeight: 450.49034

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC2=C(C=C1)OCO2)C3=NC=NC4=CC(=C(C=C43)[N+](=O)[O-])N5CCNCC5

Isomeric SMILES

CCCN(CC1=CC2=C(C=C1)OCO2)C3=NC=NC4=CC(=C(C=C43)[N+](=O)[O-])N5CCNCC5

InChI

InChI=1S/C23H26N6O4/c1-2-7-28(13-16-3-4-21-22(10-16)33-15-32-21)23-17-11-20(29(30)31)19(12-18(17)25-14-26-23)27-8-5-24-6-9-27/h3-4,10-12,14,24H,2,5-9,13,15H2,1H3