(E)-1-[3-(hydroxymethyl)piperidin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[3-(hydroxymethyl)piperidin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-[3-(hydroxymethyl)-1-piperidyl]-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[3-(hydroxymethyl)-1-piperidinyl]-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[3-(hydroxymethyl)piperidin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(3-methylolpiperidino)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])CO

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])CO

InChI

InChI=1S/C15H18N2O4/c18-11-13-4-2-8-16(10-13)15(19)7-6-12-3-1-5-14(9-12)17(20)21/h1,3,5-7,9,13,18H,2,4,8,10-11H2/b7-6+