2-[4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-(naphthionylamino)piperidino]ethyl ester Formula: C27H33ClN4O5S MolecularWeight: 561.09272

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC3CCN(CC3)CCOC(=O)C4=CC(=C(C=C4OC)N)Cl

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC3CCN(CC3)CCOC(=O)C4=CC(=C(C=C4OC)N)Cl

InChI

InChI=1S/C27H33ClN4O5S/c1-31(2)24-8-4-7-20-19(24)6-5-9-26(20)38(34,35)30-18-10-12-32(13-11-18)14-15-37-27(33)21-16-22(28)23(29)17-25(21)36-3/h4-9,16-18,30H,10-15,29H2,1-3H3