[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-(benzotriazol-1-ylmethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-(benzotriazol-1-ylmethyl)benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-(benzotriazol-1-ylmethyl)benzoate CAS Name: 4-(1-benzotriazolylmethyl)benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-(benzotriazol-1-ylmethyl)benzoate Traditional Name: 4-(benzotriazol-1-ylmethyl)benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C21H24N4O3/c1-3-17(4-2)22-20(26)14-28-21(27)16-11-9-15(10-12-16)13-25-19-8-6-5-7-18(19)23-24-25/h5-12,17H,3-4,13-14H2,1-2H3,(H,22,26)