3-azanyl-4-[2-[methyl-[5-(piperidin-1-ylmethyl)furan-2-yl]amino]ethyl]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-azanyl-4-[2-[methyl-[5-(piperidin-1-ylmethyl)furan-2-yl]amino]ethyl]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[2-[methyl-[5-(1-piperidylmethyl)-2-furyl]amino]ethyl]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[2-[methyl-[5-(1-piperidinylmethyl)-2-furanyl]amino]ethyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[2-[methyl-[5-(piperidin-1-ylmethyl)furan-2-yl]amino]ethyl]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[2-[methyl-[5-(piperidinomethyl)-2-furyl]amino]ethyl]cyclobut-3-ene-1,2-quinone Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=C(C(=O)C1=O)N)C2=CC=C(O2)CN3CCCCC3

Isomeric SMILES

CN(CCC1=C(C(=O)C1=O)N)C2=CC=C(O2)CN3CCCCC3

InChI

InChI=1S/C17H23N3O3/c1-19(10-7-13-15(18)17(22)16(13)21)14-6-5-12(23-14)11-20-8-3-2-4-9-20/h5-6H,2-4,7-11,18H2,1H3