hexadecyl 3-[[2-(benzotriazol-1-yl)-2-methoxy-ethanoyl]amino]-2-methyl-benzoate

Systemtic Name: hexadecyl 3-[[2-(benzotriazol-1-yl)-2-methoxy-ethanoyl]amino]-2-methyl-benzoate Openeye Name: hexadecyl 3-[[2-(benzotriazol-1-yl)-2-methoxy-acetyl]amino]-2-methyl-benzoate CAS Name: 3-[[2-(1-benzotriazolyl)-2-methoxy-1-oxoethyl]amino]-2-methylbenzoic acid hexadecyl ester IUPAC Name: hexadecyl 3-[[2-(benzotriazol-1-yl)-2-methoxyacetyl]amino]-2-methylbenzoate Traditional Name: 3-[[2-(benzotriazol-1-yl)-2-methoxy-acetyl]amino]-2-methyl-benzoic acid cetyl ester Formula: C33H48N4O4 MolecularWeight: 564.75862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H48N4O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-41-33(39)27-21-20-23-28(26(27)2)34-31(38)32(40-3)37-30-24-18-17-22-29(30)35-36-37/h17-18,20-24,32H,4-16,19,25H2,1-3H3,(H,34,38)