1-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-6-nitro-7-piperazin-1-yl-4H-quinazolin-2-amine

Systemtic Name: 1-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-6-nitro-7-piperazin-1-yl-4H-quinazolin-2-amine Openeye Name: 1-[1-[(4-methoxyphenyl)methyl]-4-piperidyl]-6-nitro-7-piperazin-1-yl-4H-quinazolin-2-amine CAS Name: 1-[1-[(4-methoxyphenyl)methyl]-4-piperidinyl]-6-nitro-7-(1-piperazinyl)-4H-quinazolin-2-amine IUPAC Name: 1-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-6-nitro-7-piperazin-1-yl-4H-quinazolin-2-amine Traditional Name: [6-nitro-1-(1-p-anisyl-4-piperidyl)-7-piperazino-4H-quinazolin-2-yl]amine Formula: C25H33N7O3 MolecularWeight: 479.57462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCC(CC2)N3C4=CC(=C(C=C4CN=C3N)[N+](=O)[O-])N5CCNCC5

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCC(CC2)N3C4=CC(=C(C=C4CN=C3N)[N+](=O)[O-])N5CCNCC5

InChI

InChI=1S/C25H33N7O3/c1-35-21-4-2-18(3-5-21)17-29-10-6-20(7-11-29)31-22-15-23(30-12-8-27-9-13-30)24(32(33)34)14-19(22)16-28-25(31)26/h2-5,14-15,20,27H,6-13,16-17H2,1H3,(H2,26,28)