1-nitro-4-(3,3,3-trimethoxypropyl)benzene

Systemtic Name: 1-nitro-4-(3,3,3-trimethoxypropyl)benzene Openeye Name: 1-nitro-4-(3,3,3-trimethoxypropyl)benzene CAS Name: 1-nitro-4-(3,3,3-trimethoxypropyl)benzene IUPAC Name: 1-nitro-4-(3,3,3-trimethoxypropyl)benzene Traditional Name: 1-nitro-4-(3,3,3-trimethoxypropyl)benzene Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

COC(CCC1=CC=C(C=C1)[N+](=O)[O-])(OC)OC

Isomeric SMILES

COC(CCC1=CC=C(C=C1)[N+](=O)[O-])(OC)OC

InChI

InChI=1S/C12H17NO5/c1-16-12(17-2,18-3)9-8-10-4-6-11(7-5-10)13(14)15/h4-7H,8-9H2,1-3H3