[1-(naphthalen-1-ylamino)-1-oxidanylidene-butan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-(naphthalen-1-ylamino)-1-oxidanylidene-butan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Openeye Name: 1-(1-naphthylcarbamoyl)propyl 2-phenyl-3H-benzimidazole-5-carboxylate CAS Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [1-(1-naphthalenylamino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(naphthalen-1-ylamino)-1-oxobutan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Traditional Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid 1-(1-naphthylcarbamoyl)propyl ester Formula: C28H23N3O3 MolecularWeight: 449.50052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=CC=C5

InChI

InChI=1S/C28H23N3O3/c1-2-25(27(32)31-22-14-8-12-18-9-6-7-13-21(18)22)34-28(33)20-15-16-23-24(17-20)30-26(29-23)19-10-4-3-5-11-19/h3-17,25H,2H2,1H3,(H,29,30)(H,31,32)