methyl 3-[(4-acetamido-5-chloranyl-2-methoxy-phenyl)carbonylamino]-9-azabicyclo[3.3.1]nonane-9-carboxylate

Systemtic Name: methyl 3-[(4-acetamido-5-chloranyl-2-methoxy-phenyl)carbonylamino]-9-azabicyclo[3.3.1]nonane-9-carboxylate Openeye Name: methyl 3-[(4-acetamido-5-chloro-2-methoxy-benzoyl)amino]-9-azabicyclo[3.3.1]nonane-9-carboxylate CAS Name: 3-[[(4-acetamido-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-9-azabicyclo[3.3.1]nonane-9-carboxylic acid methyl ester IUPAC Name: methyl 3-[(4-acetamido-5-chloro-2-methoxybenzoyl)amino]-9-azabicyclo[3.3.1]nonane-9-carboxylate Traditional Name: 3-[(4-acetamido-5-chloro-2-methoxy-benzoyl)amino]-9-azabicyclo[3.3.1]nonane-9-carboxylic acid methyl ester Formula: C20H26ClN3O5 MolecularWeight: 423.89054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2CC3CCCC(C2)N3C(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2CC3CCCC(C2)N3C(=O)OC)Cl

InChI

InChI=1S/C20H26ClN3O5/c1-11(25)22-17-10-18(28-2)15(9-16(17)21)19(26)23-12-7-13-5-4-6-14(8-12)24(13)20(27)29-3/h9-10,12-14H,4-8H2,1-3H3,(H,22,25)(H,23,26)