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

Systemtic Name: ethyl 2-[3-[2-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]ethyl]-9-azabicyclo[3.3.1]nonan-9-yl]ethanoate Openeye Name: ethyl 2-[3-[2-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]ethyl]-9-azabicyclo[3.3.1]nonan-9-yl]acetate CAS Name: 2-[3-[2-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]ethyl]-9-azabicyclo[3.3.1]nonan-9-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[2-[(4-amino-5-chloro-2-methoxybenzoyl)amino]ethyl]-9-azabicyclo[3.3.1]nonan-9-yl]acetate Traditional Name: 2-[3-[2-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]ethyl]-9-azabicyclo[3.3.1]nonan-9-yl]acetic acid ethyl ester Formula: C22H32ClN3O4 MolecularWeight: 437.96018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2CCCC1CC(C2)CCNC(=O)C3=CC(=C(C=C3OC)N)Cl

Isomeric SMILES

CCOC(=O)CN1C2CCCC1CC(C2)CCNC(=O)C3=CC(=C(C=C3OC)N)Cl

InChI

InChI=1S/C22H32ClN3O4/c1-3-30-21(27)13-26-15-5-4-6-16(26)10-14(9-15)7-8-25-22(28)17-11-18(23)19(24)12-20(17)29-2/h11-12,14-16H,3-10,13,24H2,1-2H3,(H,25,28)