ethyl 5-[3-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-9-azabicyclo[3.3.1]nonan-9-yl]pentanoate

Systemtic Name: ethyl 5-[3-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-9-azabicyclo[3.3.1]nonan-9-yl]pentanoate Openeye Name: ethyl 5-[3-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-9-azabicyclo[3.3.1]nonan-9-yl]pentanoate CAS Name: 5-[3-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-9-azabicyclo[3.3.1]nonan-9-yl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-9-azabicyclo[3.3.1]nonan-9-yl]pentanoate Traditional Name: 5-[3-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-9-azabicyclo[3.3.1]nonan-9-yl]valeric acid ethyl ester Formula: C23H34ClN3O4 MolecularWeight: 451.98676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C2CCCC1CC(C2)NC(=O)C3=CC(=C(C=C3OC)N)Cl

Isomeric SMILES

CCOC(=O)CCCCN1C2CCCC1CC(C2)NC(=O)C3=CC(=C(C=C3OC)N)Cl

InChI

InChI=1S/C23H34ClN3O4/c1-3-31-22(28)9-4-5-10-27-16-7-6-8-17(27)12-15(11-16)26-23(29)18-13-19(24)20(25)14-21(18)30-2/h13-17H,3-12,25H2,1-2H3,(H,26,29)