N-[2-nitro-4-[(E)-3-[1-(phenylmethyl)piperidin-4-yl]prop-2-enoyl]phenyl]ethanamide

Systemtic Name: N-[2-nitro-4-[(E)-3-[1-(phenylmethyl)piperidin-4-yl]prop-2-enoyl]phenyl]ethanamide Openeye Name: N-[4-[(E)-3-(1-benzyl-4-piperidyl)prop-2-enoyl]-2-nitro-phenyl]acetamide CAS Name: N-[2-nitro-4-[(E)-1-oxo-3-[1-(phenylmethyl)-4-piperidinyl]prop-2-enyl]phenyl]acetamide IUPAC Name: N-[4-[(E)-3-(1-benzylpiperidin-4-yl)prop-2-enoyl]-2-nitrophenyl]acetamide Traditional Name: N-[4-[(E)-3-(1-benzyl-4-piperidyl)acryloyl]-2-nitro-phenyl]acetamide Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(=O)C=CC2CCN(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(=O)/C=C/C2CCN(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O4/c1-17(27)24-21-9-8-20(15-22(21)26(29)30)23(28)10-7-18-11-13-25(14-12-18)16-19-5-3-2-4-6-19/h2-10,15,18H,11-14,16H2,1H3,(H,24,27)/b10-7+