3-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]-2-methyl-propanoic acid

Systemtic Name: 3-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]-2-methyl-propanoic acid Openeye Name: 3-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-1-piperidyl]-2-methyl-propanoic acid CAS Name: 3-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methoxy-1-piperidinyl]-2-methylpropanoic acid IUPAC Name: 3-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methoxypiperidin-1-yl]-2-methylpropanoic acid Traditional Name: 3-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-piperidino]-2-methyl-propionic acid Formula: C18H26ClN3O5 MolecularWeight: 399.86914

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC(C(C1)OC)NC(=O)C2=CC(=C(C=C2OC)N)Cl)C(=O)O

Isomeric SMILES

CC(CN1CCC(C(C1)OC)NC(=O)C2=CC(=C(C=C2OC)N)Cl)C(=O)O

InChI

InChI=1S/C18H26ClN3O5/c1-10(18(24)25)8-22-5-4-14(16(9-22)27-3)21-17(23)11-6-12(19)13(20)7-15(11)26-2/h6-7,10,14,16H,4-5,8-9,20H2,1-3H3,(H,21,23)(H,24,25)