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

Systemtic Name: 5-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]pentylcarbamic acid Openeye Name: 5-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-1-piperidyl]pentylcarbamic acid CAS Name: 5-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methoxy-1-piperidinyl]pentylcarbamic acid IUPAC Name: 5-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methoxypiperidin-1-yl]pentylcarbamic acid Traditional Name: 5-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-piperidino]pentylcarbamic acid Formula: C20H31ClN4O5 MolecularWeight: 442.93694

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCCCNC(=O)O

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCCCNC(=O)O

InChI

InChI=1S/C20H31ClN4O5/c1-29-17-11-15(22)14(21)10-13(17)19(26)24-16-6-9-25(12-18(16)30-2)8-5-3-4-7-23-20(27)28/h10-11,16,18,23H,3-9,12,22H2,1-2H3,(H,24,26)(H,27,28)