2-[4-[2-(2-azanylethoxy)ethylcarbamoyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-[2-(2-azanylethoxy)ethylcarbamoyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[2-(2-aminoethoxy)ethylcarbamoyl]-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[[2-(2-aminoethoxy)ethylamino]-oxomethyl]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[2-(2-aminoethoxy)ethylcarbamoyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-[2-(2-aminoethoxy)ethylcarbamoyl]piperidino]ethyl ester Formula: C20H31ClN4O5 MolecularWeight: 442.93694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)C(=O)NCCOCCN)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)C(=O)NCCOCCN)Cl)N

InChI

InChI=1S/C20H31ClN4O5/c1-28-18-13-17(23)16(21)12-15(18)20(27)30-11-8-25-6-2-14(3-7-25)19(26)24-5-10-29-9-4-22/h12-14H,2-11,22-23H2,1H3,(H,24,26)