6-[4-[[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]methoxy]piperidin-1-yl]hexanoic acid

Systemtic Name: 6-[4-[[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]methoxy]piperidin-1-yl]hexanoic acid Openeye Name: 6-[4-[[(4-amino-5-chloro-2-methoxy-benzoyl)amino]methoxy]-1-piperidyl]hexanoic acid CAS Name: 6-[4-[[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]methoxy]-1-piperidinyl]hexanoic acid IUPAC Name: 6-[4-[[(4-amino-5-chloro-2-methoxybenzoyl)amino]methoxy]piperidin-1-yl]hexanoic acid Traditional Name: 6-[4-[[(4-amino-5-chloro-2-methoxy-benzoyl)amino]methoxy]piperidino]hexanoic acid Formula: C20H30ClN3O5 MolecularWeight: 427.9223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCOC2CCN(CC2)CCCCCC(=O)O)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCOC2CCN(CC2)CCCCCC(=O)O)Cl)N

InChI

InChI=1S/C20H30ClN3O5/c1-28-18-12-17(22)16(21)11-15(18)20(27)23-13-29-14-6-9-24(10-7-14)8-4-2-3-5-19(25)26/h11-12,14H,2-10,13,22H2,1H3,(H,23,27)(H,25,26)