(Z)-but-2-enedioic acid; 1-(2-chloroethyl)-3-(1-ethylpiperidin-3-yl)-1-nitroso-urea

Systemtic Name: (Z)-but-2-enedioic acid; 1-(2-chloroethyl)-3-(1-ethylpiperidin-3-yl)-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-(1-ethyl-3-piperidyl)-1-nitroso-urea; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-(2-chloroethyl)-3-(1-ethyl-3-piperidinyl)-1-nitrosourea IUPAC Name: (Z)-but-2-enedioic acid; 1-(2-chloroethyl)-3-(1-ethylpiperidin-3-yl)-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-(1-ethyl-3-piperidyl)-1-nitroso-urea; maleic acid Formula: C14H23ClN4O6 MolecularWeight: 378.80862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)NC(=O)N(CCCl)N=O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN1CCCC(C1)NC(=O)N(CCCl)N=O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C10H19ClN4O2.C4H4O4/c1-2-14-6-3-4-9(8-14)12-10(16)15(13-17)7-5-11;5-3(6)1-2-4(7)8/h9H,2-8H2,1H3,(H,12,16);1-2H,(H,5,6)(H,7,8)/b;2-1-