2-[4-(thiophen-3-ylcarbonylamino)piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-(thiophen-3-ylcarbonylamino)piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-(thiophene-3-carbonylamino)-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[[oxo(3-thiophenyl)methyl]amino]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-(thiophene-3-carbonylamino)piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-(3-thenoylamino)piperidino]ethyl ester Formula: C20H24ClN3O4S MolecularWeight: 437.94026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)NC(=O)C3=CSC=C3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)NC(=O)C3=CSC=C3)Cl)N

InChI

InChI=1S/C20H24ClN3O4S/c1-27-18-11-17(22)16(21)10-15(18)20(26)28-8-7-24-5-2-14(3-6-24)23-19(25)13-4-9-29-12-13/h4,9-12,14H,2-3,5-8,22H2,1H3,(H,23,25)