ethyl 2-[4-(nitromethyl)-1-(phenylmethyl)piperidin-4-yl]ethanoate

Systemtic Name: ethyl 2-[4-(nitromethyl)-1-(phenylmethyl)piperidin-4-yl]ethanoate Openeye Name: ethyl 2-[1-benzyl-4-(nitromethyl)-4-piperidyl]acetate CAS Name: 2-[4-(nitromethyl)-1-(phenylmethyl)-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-benzyl-4-(nitromethyl)piperidin-4-yl]acetate Traditional Name: 2-[1-benzyl-4-(nitromethyl)-4-piperidyl]acetic acid ethyl ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCN(CC1)CC2=CC=CC=C2)C[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1(CCN(CC1)CC2=CC=CC=C2)C[N+](=O)[O-]

InChI

InChI=1S/C17H24N2O4/c1-2-23-16(20)12-17(14-19(21)22)8-10-18(11-9-17)13-15-6-4-3-5-7-15/h3-7H,2,8-14H2,1H3