2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(4-piperidin-1-ylcarbonylphenyl)amino]prop-2-enal

Systemtic Name: 2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(4-piperidin-1-ylcarbonylphenyl)amino]prop-2-enal Openeye Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-[4-(piperidine-1-carbonyl)anilino]prop-2-enal CAS Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-[4-[oxo(1-piperidinyl)methyl]anilino]-2-propenal IUPAC Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-[4-(piperidine-1-carbonyl)anilino]prop-2-enal Traditional Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-[4-(piperidine-1-carbonyl)anilino]acrolein Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC=C(C=O)C3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC=C(C=O)C3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C22H20ClN3O3/c23-17-6-9-20-19(12-17)25-21(29-20)16(14-27)13-24-18-7-4-15(5-8-18)22(28)26-10-2-1-3-11-26/h4-9,12-14,24H,1-3,10-11H2