1-methoxy-4-nitro-2-tetradecan-2-yl-benzene

Systemtic Name: 1-methoxy-4-nitro-2-tetradecan-2-yl-benzene Openeye Name: 1-methoxy-2-(1-methyltridecyl)-4-nitro-benzene CAS Name: 1-methoxy-4-nitro-2-tetradecan-2-ylbenzene IUPAC Name: 1-methoxy-4-nitro-2-tetradecan-2-ylbenzene Traditional Name: 1-methoxy-2-(1-methyltridecyl)-4-nitro-benzene Formula: C21H35NO3 MolecularWeight: 349.5075

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)C1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCCCCCCCCC(C)C1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C21H35NO3/c1-4-5-6-7-8-9-10-11-12-13-14-18(2)20-17-19(22(23)24)15-16-21(20)25-3/h15-18H,4-14H2,1-3H3