[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-(benzimidazol-1-yl)ethanoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-(benzimidazol-1-yl)ethanoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 2-(benzimidazol-1-yl)acetate CAS Name: 2-(1-benzimidazolyl)acetic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 2-(benzimidazol-1-yl)acetate Traditional Name: 2-(benzimidazol-1-yl)acetic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)CN2C=NC3=CC=CC=C32

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)CN2C=NC3=CC=CC=C32

InChI

InChI=1S/C21H23N3O3/c1-2-3-6-16-9-11-17(12-10-16)23-20(25)14-27-21(26)13-24-15-22-18-7-4-5-8-19(18)24/h4-5,7-12,15H,2-3,6,13-14H2,1H3,(H,23,25)