4-[4-(hydroxymethyl)piperidin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-(hydroxymethyl)piperidin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-(hydroxymethyl)-1-piperidyl]-3-nitro-benzaldehyde CAS Name: 4-[4-(hydroxymethyl)-1-piperidinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-(hydroxymethyl)piperidin-1-yl]-3-nitrobenzaldehyde Traditional Name: 4-(4-methylolpiperidino)-3-nitro-benzaldehyde Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)C2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CO)C2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O4/c16-8-10-3-5-14(6-4-10)12-2-1-11(9-17)7-13(12)15(18)19/h1-2,7,9-10,16H,3-6,8H2