2-nitro-5-[3-(piperidin-1-ylmethyl)phenoxy]pent-1-ene-1,1-diamine

Systemtic Name: 2-nitro-5-[3-(piperidin-1-ylmethyl)phenoxy]pent-1-ene-1,1-diamine Openeye Name: 2-nitro-5-[3-(1-piperidylmethyl)phenoxy]pent-1-ene-1,1-diamine CAS Name: 2-nitro-5-[3-(1-piperidinylmethyl)phenoxy]-1-pentene-1,1-diamine IUPAC Name: 2-nitro-5-[3-(piperidin-1-ylmethyl)phenoxy]pent-1-ene-1,1-diamine Traditional Name: [1-amino-2-nitro-5-[3-(piperidinomethyl)phenoxy]pent-1-enyl]amine Formula: C17H26N4O3 MolecularWeight: 334.41334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCC(=C(N)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCC(=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O3/c18-17(19)16(21(22)23)8-5-11-24-15-7-4-6-14(12-15)13-20-9-2-1-3-10-20/h4,6-7,12H,1-3,5,8-11,13,18-19H2