2-[2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]amino]ethyl-[3-(4-nitrophenyl)propyl]amino]propyl ethanoate

Systemtic Name: 2-[2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]amino]ethyl-[3-(4-nitrophenyl)propyl]amino]propyl ethanoate Openeye Name: 2-[2-[(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)amino]ethyl-[3-(4-nitrophenyl)propyl]amino]propyl acetate CAS Name: acetic acid 2-[2-[(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)amino]ethyl-[3-(4-nitrophenyl)propyl]amino]propyl ester IUPAC Name: 2-[2-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)amino]ethyl-[3-(4-nitrophenyl)propyl]amino]propyl acetate Traditional Name: acetic acid 2-[2-[(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)amino]ethyl-[3-(4-nitrophenyl)propyl]amino]propyl ester Formula: C22H31N5O6 MolecularWeight: 461.51144

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C)N(CCCC1=CC=C(C=C1)[N+](=O)[O-])CCNC2=CC(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(COC(=O)C)N(CCCC1=CC=C(C=C1)[N+](=O)[O-])CCNC2=CC(=O)N(C(=O)N2C)C

InChI

InChI=1S/C22H31N5O6/c1-16(15-33-17(2)28)26(12-5-6-18-7-9-19(10-8-18)27(31)32)13-11-23-20-14-21(29)25(4)22(30)24(20)3/h7-10,14,16,23H,5-6,11-13,15H2,1-4H3