ethanoyl 2-[1-[1-[3-acetyloxy-2-(acetyloxymethyl)-2-methyl-propyl]-7-chloranyl-5-(2,3-dimethoxyphenyl)-2-oxidanylidene-5H-4,1-benzoxazepin-3-yl]piperidin-4-yl]ethanoate

Systemtic Name: ethanoyl 2-[1-[1-[3-acetyloxy-2-(acetyloxymethyl)-2-methyl-propyl]-7-chloranyl-5-(2,3-dimethoxyphenyl)-2-oxidanylidene-5H-4,1-benzoxazepin-3-yl]piperidin-4-yl]ethanoate Openeye Name: acetyl 2-[1-[1-[3-acetoxy-2-(acetoxymethyl)-2-methyl-propyl]-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]-4-piperidyl]acetate CAS Name: 2-[1-[1-[3-acetyloxy-2-(acetyloxymethyl)-2-methylpropyl]-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]-4-piperidinyl]acetic acid acetyl ester IUPAC Name: acetyl 2-[1-[1-[3-acetyloxy-2-(acetyloxymethyl)-2-methylpropyl]-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]piperidin-4-yl]acetate Traditional Name: 2-[1-[1-[3-acetoxy-2-(acetoxymethyl)-2-methyl-propyl]-7-chloro-5-(2,3-dimethoxyphenyl)-2-keto-5H-4,1-benzoxazepin-3-yl]-4-piperidyl]acetic acid acetyl ester Formula: C35H43ClN2O11 MolecularWeight: 703.17572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(CN1C2=C(C=C(C=C2)Cl)C(OC(C1=O)N3CCC(CC3)CC(=O)OC(=O)C)C4=C(C(=CC=C4)OC)OC)COC(=O)C

Isomeric SMILES

CC(=O)OCC(C)(CN1C2=C(C=C(C=C2)Cl)C(OC(C1=O)N3CCC(CC3)CC(=O)OC(=O)C)C4=C(C(=CC=C4)OC)OC)COC(=O)C

InChI

InChI=1S/C35H43ClN2O11/c1-21(39)46-19-35(4,20-47-22(2)40)18-38-28-11-10-25(36)17-27(28)31(26-8-7-9-29(44-5)32(26)45-6)49-34(33(38)43)37-14-12-24(13-15-37)16-30(42)48-23(3)41/h7-11,17,24,31,34H,12-16,18-20H2,1-6H3