N-(3-methoxypropyl)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-2-piperidin-1-yl-benzamide

Systemtic Name: N-(3-methoxypropyl)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-2-piperidin-1-yl-benzamide Openeye Name: N-(3-methoxypropyl)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-2-(1-piperidyl)benzamide CAS Name: N-(3-methoxypropyl)-5-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]-2-(1-piperidinyl)benzamide IUPAC Name: N-(3-methoxypropyl)-5-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-2-piperidin-1-ylbenzamide Traditional Name: N-(3-methoxypropyl)-5-[[(E)-3-(4-nitrophenyl)acryloyl]amino]-2-piperidino-benzamide Formula: C25H30N4O5 MolecularWeight: 466.5295

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

COCCCNC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C25H30N4O5/c1-34-17-5-14-26-25(31)22-18-20(9-12-23(22)28-15-3-2-4-16-28)27-24(30)13-8-19-6-10-21(11-7-19)29(32)33/h6-13,18H,2-5,14-17H2,1H3,(H,26,31)(H,27,30)/b13-8+