11-(dimethylaminomethyl)-9-nitro-6H-benzo[c][1]benzoxepin-11-ol

Systemtic Name: 11-(dimethylaminomethyl)-9-nitro-6H-benzo[c][1]benzoxepin-11-ol Openeye Name: 11-(dimethylaminomethyl)-9-nitro-6H-benzo[c][1]benzoxepin-11-ol CAS Name: 11-(dimethylaminomethyl)-9-nitro-6H-benzo[c][1]benzoxepin-11-ol IUPAC Name: 11-(dimethylaminomethyl)-9-nitro-6H-benzo[c][1]benzoxepin-11-ol Traditional Name: 11-(dimethylaminomethyl)-9-nitro-6H-benzo[c][1]benzoxepin-11-ol Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1(C2=CC=CC=C2OCC3=C1C=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CN(C)CC1(C2=CC=CC=C2OCC3=C1C=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H18N2O4/c1-18(2)11-17(20)14-5-3-4-6-16(14)23-10-12-7-8-13(19(21)22)9-15(12)17/h3-9,20H,10-11H2,1-2H3