2-[2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]amino]ethyl-[3-(4-prop-2-enoxyphenyl)propyl]amino]ethyl benzoate

Systemtic Name: 2-[2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]amino]ethyl-[3-(4-prop-2-enoxyphenyl)propyl]amino]ethyl benzoate Openeye Name: 2-[3-(4-allyloxyphenyl)propyl-[2-[(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)amino]ethyl]amino]ethyl benzoate CAS Name: benzoic acid 2-[2-[(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)amino]ethyl-[3-(4-prop-2-enoxyphenyl)propyl]amino]ethyl ester IUPAC Name: 2-[2-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)amino]ethyl-[3-(4-prop-2-enoxyphenyl)propyl]amino]ethyl benzoate Traditional Name: benzoic acid 2-[3-(4-allyloxyphenyl)propyl-[2-[(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)amino]ethyl]amino]ethyl ester Formula: C29H36N4O5 MolecularWeight: 520.61994

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NCCN(CCCC2=CC=C(C=C2)OCC=C)CCOC(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NCCN(CCCC2=CC=C(C=C2)OCC=C)CCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H36N4O5/c1-4-20-37-25-14-12-23(13-15-25)9-8-17-33(19-21-38-28(35)24-10-6-5-7-11-24)18-16-30-26-22-27(34)32(3)29(36)31(26)2/h4-7,10-15,22,30H,1,8-9,16-21H2,2-3H3