2-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]ethyl pyrrolidine-1-carboxylate

Systemtic Name: 2-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]ethyl pyrrolidine-1-carboxylate Openeye Name: 2-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-1-piperidyl]ethyl pyrrolidine-1-carboxylate CAS Name: 1-pyrrolidinecarboxylic acid 2-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methoxy-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methoxypiperidin-1-yl]ethyl pyrrolidine-1-carboxylate Traditional Name: pyrrolidine-1-carboxylic acid 2-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-piperidino]ethyl ester Formula: C21H31ClN4O5 MolecularWeight: 454.94764

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCOC(=O)N3CCCC3

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCOC(=O)N3CCCC3

InChI

InChI=1S/C21H31ClN4O5/c1-29-18-12-16(23)15(22)11-14(18)20(27)24-17-5-8-25(13-19(17)30-2)9-10-31-21(28)26-6-3-4-7-26/h11-12,17,19H,3-10,13,23H2,1-2H3,(H,24,27)