N-[4-[4-[(2-oxidanyl-2-prop-2-enyl-pent-4-enyl)amino]piperidin-1-yl]phenyl]-3-phenyl-propanamide

Systemtic Name: N-[4-[4-[(2-oxidanyl-2-prop-2-enyl-pent-4-enyl)amino]piperidin-1-yl]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[4-[(2-allyl-2-hydroxy-pent-4-enyl)amino]-1-piperidyl]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[4-[(2-hydroxy-2-prop-2-enylpent-4-enyl)amino]-1-piperidinyl]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[4-[(2-hydroxy-2-prop-2-enylpent-4-enyl)amino]piperidin-1-yl]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[4-[(2-allyl-2-hydroxy-pent-4-enyl)amino]piperidino]phenyl]-3-phenyl-propionamide Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(CNC1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)O

Isomeric SMILES

C=CCC(CC=C)(CNC1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)O

InChI

InChI=1S/C28H37N3O2/c1-3-18-28(33,19-4-2)22-29-24-16-20-31(21-17-24)26-13-11-25(12-14-26)30-27(32)15-10-23-8-6-5-7-9-23/h3-9,11-14,24,29,33H,1-2,10,15-22H2,(H,30,32)