methyl 2-[[1-[2-(benzotriazol-1-ylmethylamino)-2-oxidanylidene-1-phenyl-ethyl]-4-oxidanylidene-azetidin-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[1-[2-(benzotriazol-1-ylmethylamino)-2-oxidanylidene-1-phenyl-ethyl]-4-oxidanylidene-azetidin-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[1-[2-(benzotriazol-1-ylmethylamino)-2-oxo-1-phenyl-ethyl]-4-oxo-azetidine-2-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[1-[2-(1-benzotriazolylmethylamino)-2-oxo-1-phenylethyl]-4-oxo-2-azetidinyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[1-[2-(benzotriazol-1-ylmethylamino)-2-oxo-1-phenylethyl]-4-oxoazetidine-2-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[1-[2-(benzotriazol-1-ylmethylamino)-2-keto-1-phenyl-ethyl]-4-keto-azetidine-2-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C29H28N6O5 MolecularWeight: 540.56982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CC(=O)N2C(C3=CC=CC=C3)C(=O)NCN4C5=CC=CC=C5N=N4

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CC(=O)N2C(C3=CC=CC=C3)C(=O)NCN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H28N6O5/c1-40-29(39)22(16-19-10-4-2-5-11-19)31-27(37)24-17-25(36)35(24)26(20-12-6-3-7-13-20)28(38)30-18-34-23-15-9-8-14-21(23)32-33-34/h2-15,22,24,26H,16-18H2,1H3,(H,30,38)(H,31,37)