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

Systemtic Name: octadecyl 4-[[1,3-dimethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: octadecyl 4-[(1,3-dimethyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzoic acid octadecyl ester IUPAC Name: octadecyl 4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 4-[(2,4,6-triketo-1,3-dimethyl-hexahydropyrimidin-5-ylidene)methylamino]benzoic acid stearyl ester Formula: C32H49N3O5 MolecularWeight: 555.74856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C32H49N3O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-40-31(38)26-20-22-27(23-21-26)33-25-28-29(36)34(2)32(39)35(3)30(28)37/h20-23,25,33H,4-19,24H2,1-3H3