N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-[(E)-3-methoxy-3-oxidanyl-prop-1-enyl]phenyl]-1-propan-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-[(E)-3-methoxy-3-oxidanyl-prop-1-enyl]phenyl]-1-propan-2-yl-piperidine-4-carboxamide Openeye Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-[(E)-3-hydroxy-3-methoxy-prop-1-enyl]phenyl]-1-isopropyl-piperidine-4-carboxamide CAS Name: N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-[(E)-3-hydroxy-3-methoxyprop-1-enyl]phenyl]-1-propan-2-yl-4-piperidinecarboxamide IUPAC Name: N-[2-[(5-chloropyridin-2-yl)carbamoyl]-4-[(E)-3-hydroxy-3-methoxyprop-1-enyl]phenyl]-1-propan-2-ylpiperidine-4-carboxamide Traditional Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-[(E)-3-hydroxy-3-methoxy-prop-1-enyl]phenyl]-1-isopropyl-isonipecotamide Formula: C25H31ClN4O4 MolecularWeight: 486.99104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)C=CC(O)OC)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)/C=C/C(O)OC)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C25H31ClN4O4/c1-16(2)30-12-10-18(11-13-30)24(32)28-21-7-4-17(5-9-23(31)34-3)14-20(21)25(33)29-22-8-6-19(26)15-27-22/h4-9,14-16,18,23,31H,10-13H2,1-3H3,(H,28,32)(H,27,29,33)/b9-5+