tetradecyl 3-[[2-(benzotriazol-1-yl)-2-methoxy-ethanoyl]amino]-2-bromanyl-benzoate

Systemtic Name: tetradecyl 3-[[2-(benzotriazol-1-yl)-2-methoxy-ethanoyl]amino]-2-bromanyl-benzoate Openeye Name: tetradecyl 3-[[2-(benzotriazol-1-yl)-2-methoxy-acetyl]amino]-2-bromo-benzoate CAS Name: 3-[[2-(1-benzotriazolyl)-2-methoxy-1-oxoethyl]amino]-2-bromobenzoic acid tetradecyl ester IUPAC Name: tetradecyl 3-[[2-(benzotriazol-1-yl)-2-methoxyacetyl]amino]-2-bromobenzoate Traditional Name: 3-[[2-(benzotriazol-1-yl)-2-methoxy-acetyl]amino]-2-bromo-benzoic acid myristyl ester Formula: C30H41BrN4O4 MolecularWeight: 601.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C1=C(C(=CC=C1)NC(=O)C(N2C3=CC=CC=C3N=N2)OC)Br

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C1=C(C(=CC=C1)NC(=O)C(N2C3=CC=CC=C3N=N2)OC)Br

InChI

InChI=1S/C30H41BrN4O4/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-39-30(37)23-18-17-20-25(27(23)31)32-28(36)29(38-2)35-26-21-15-14-19-24(26)33-34-35/h14-15,17-21,29H,3-13,16,22H2,1-2H3,(H,32,36)