3-[1-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]piperidin-4-yl]-N-methyl-N-(phenylmethyl)propanamide

Systemtic Name: 3-[1-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]piperidin-4-yl]-N-methyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-[1-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]-4-piperidyl]-N-methyl-propanamide CAS Name: 3-[1-[(E)-3-(1H-imidazol-5-yl)-1-oxoprop-2-enyl]-4-piperidinyl]-N-methyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-[1-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]piperidin-4-yl]-N-methylpropanamide Traditional Name: N-benzyl-3-[1-[(E)-3-(1H-imidazol-5-yl)acryloyl]-4-piperidyl]-N-methyl-propionamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CCC2CCN(CC2)C(=O)C=CC3=CN=CN3

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CCC2CCN(CC2)C(=O)/C=C/C3=CN=CN3

InChI

InChI=1S/C22H28N4O2/c1-25(16-19-5-3-2-4-6-19)21(27)9-7-18-11-13-26(14-12-18)22(28)10-8-20-15-23-17-24-20/h2-6,8,10,15,17-18H,7,9,11-14,16H2,1H3,(H,23,24)/b10-8+