(1-dodecoxy-1-oxidanylidene-propan-2-yl) 3-[[2-(benzotriazol-1-yl)-3-[(2-chloranyl-5-ethyl-phenyl)amino]-3-oxidanylidene-propanoyl]amino]-4-chloranyl-benzoate

Systemtic Name: (1-dodecoxy-1-oxidanylidene-propan-2-yl) 3-[[2-(benzotriazol-1-yl)-3-[(2-chloranyl-5-ethyl-phenyl)amino]-3-oxidanylidene-propanoyl]amino]-4-chloranyl-benzoate Openeye Name: (2-dodecoxy-1-methyl-2-oxo-ethyl) 3-[[2-(benzotriazol-1-yl)-3-(2-chloro-5-ethyl-anilino)-3-oxo-propanoyl]amino]-4-chloro-benzoate CAS Name: 3-[[2-(1-benzotriazolyl)-3-(2-chloro-5-ethylanilino)-1,3-dioxopropyl]amino]-4-chlorobenzoic acid (1-dodecoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-dodecoxy-1-oxopropan-2-yl) 3-[[2-(benzotriazol-1-yl)-3-(2-chloro-5-ethylanilino)-3-oxopropanoyl]amino]-4-chlorobenzoate Traditional Name: 3-[[2-(benzotriazol-1-yl)-3-(2-chloro-5-ethyl-anilino)-3-keto-propanoyl]amino]-4-chloro-benzoic acid (2-keto-2-lauryloxy-1-methyl-ethyl) ester Formula: C39H47Cl2N5O6 MolecularWeight: 752.72638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(C)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)NC2=C(C=CC(=C2)CC)Cl)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(C)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)NC2=C(C=CC(=C2)CC)Cl)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C39H47Cl2N5O6/c1-4-6-7-8-9-10-11-12-13-16-23-51-38(49)26(3)52-39(50)28-20-22-30(41)33(25-28)43-37(48)35(46-34-18-15-14-17-31(34)44-45-46)36(47)42-32-24-27(5-2)19-21-29(32)40/h14-15,17-22,24-26,35H,4-13,16,23H2,1-3H3,(H,42,47)(H,43,48)