2-diethylaminoethyl 4-[[2,4,6-tris(oxidanylidene)-1-phenethyl-1,3-diazinan-5-ylidene]methylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[[2,4,6-tris(oxidanylidene)-1-phenethyl-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[(2,4,6-trioxo-1-phenethyl-hexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 4-[(2,4,6-trioxo-1-phenethyl-1,3-diazinan-5-ylidene)methylamino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(2,4,6-trioxo-1-phenethyl-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 4-[(2,4,6-triketo-1-phenethyl-hexahydropyrimidin-5-ylidene)methylamino]benzoic acid 2-diethylaminoethyl ester Formula: C26H30N4O5 MolecularWeight: 478.5402

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)CCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C26H30N4O5/c1-3-29(4-2)16-17-35-25(33)20-10-12-21(13-11-20)27-18-22-23(31)28-26(34)30(24(22)32)15-14-19-8-6-5-7-9-19/h5-13,18,27H,3-4,14-17H2,1-2H3,(H,28,31,34)