1-[3-(4-nitrophenoxy)-1,4,7,10-tetrazacyclododec-1-yl]propan-2-ol

Systemtic Name: 1-[3-(4-nitrophenoxy)-1,4,7,10-tetrazacyclododec-1-yl]propan-2-ol Openeye Name: 1-[3-(4-nitrophenoxy)-1,4,7,10-tetrazacyclododec-1-yl]propan-2-ol CAS Name: 1-[3-(4-nitrophenoxy)-1,4,7,10-tetrazacyclododec-1-yl]-2-propanol IUPAC Name: 1-[3-(4-nitrophenoxy)-1,4,7,10-tetrazacyclododec-1-yl]propan-2-ol Traditional Name: 1-[3-(4-nitrophenoxy)-1,4,7,10-tetrazacyclododec-1-yl]propan-2-ol Formula: C17H29N5O4 MolecularWeight: 367.44326

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCNCCNCCNC(C1)OC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(CN1CCNCCNCCNC(C1)OC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H29N5O4/c1-14(23)12-21-11-10-19-7-6-18-8-9-20-17(13-21)26-16-4-2-15(3-5-16)22(24)25/h2-5,14,17-20,23H,6-13H2,1H3