N-[4-azanyl-2,6-bis(oxidanylidene)-1,3-dipropyl-pyrimidin-5-yl]-4-nitro-benzamide

Systemtic Name: N-[4-azanyl-2,6-bis(oxidanylidene)-1,3-dipropyl-pyrimidin-5-yl]-4-nitro-benzamide Openeye Name: N-(4-amino-2,6-dioxo-1,3-dipropyl-pyrimidin-5-yl)-4-nitro-benzamide CAS Name: N-(4-amino-2,6-dioxo-1,3-dipropyl-5-pyrimidinyl)-4-nitrobenzamide IUPAC Name: N-(4-amino-2,6-dioxo-1,3-dipropylpyrimidin-5-yl)-4-nitrobenzamide Traditional Name: N-(4-amino-2,6-diketo-1,3-dipropyl-pyrimidin-5-yl)-4-nitro-benzamide Formula: C17H21N5O5 MolecularWeight: 375.37914

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)CCC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)CCC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C17H21N5O5/c1-3-9-20-14(18)13(16(24)21(10-4-2)17(20)25)19-15(23)11-5-7-12(8-6-11)22(26)27/h5-8H,3-4,9-10,18H2,1-2H3,(H,19,23)