dodecyl 4-chloranyl-3-[[(E)-(1-ethyl-3-methyl-benzimidazol-2-ylidene)amino]carbamoylamino]benzoate

Systemtic Name: dodecyl 4-chloranyl-3-[[(E)-(1-ethyl-3-methyl-benzimidazol-2-ylidene)amino]carbamoylamino]benzoate Openeye Name: dodecyl 4-chloro-3-[[(E)-(1-ethyl-3-methyl-benzimidazol-2-ylidene)amino]carbamoylamino]benzoate CAS Name: 4-chloro-3-[[[(2E)-2-(1-ethyl-3-methyl-2-benzimidazolylidene)hydrazinyl]-oxomethyl]amino]benzoic acid dodecyl ester IUPAC Name: dodecyl 4-chloro-3-[[(E)-(1-ethyl-3-methylbenzimidazol-2-ylidene)amino]carbamoylamino]benzoate Traditional Name: 4-chloro-3-[[(E)-(1-ethyl-3-methyl-benzimidazol-2-ylidene)amino]carbamoylamino]benzoic acid lauryl ester Formula: C30H42ClN5O3 MolecularWeight: 556.13918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)NN=C2N(C3=CC=CC=C3N2CC)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)N/N=C/2\N(C3=CC=CC=C3N2CC)C

InChI

InChI=1S/C30H42ClN5O3/c1-4-6-7-8-9-10-11-12-13-16-21-39-28(37)23-19-20-24(31)25(22-23)32-29(38)33-34-30-35(3)26-17-14-15-18-27(26)36(30)5-2/h14-15,17-20,22H,4-13,16,21H2,1-3H3,(H2,32,33,38)/b34-30+