1-[3-(2-azanylethyl)-1-methyl-indol-5-yl]urea; (E)-but-2-enedioic acid

Systemtic Name: 1-[3-(2-azanylethyl)-1-methyl-indol-5-yl]urea; (E)-but-2-enedioic acid Openeye Name: [3-(2-aminoethyl)-1-methyl-indol-5-yl]urea; fumaric acid CAS Name: [3-(2-aminoethyl)-1-methyl-5-indolyl]urea; (E)-2-butenedioic acid IUPAC Name: [3-(2-aminoethyl)-1-methylindol-5-yl]urea; (E)-but-2-enedioic acid Traditional Name: [3-(2-aminoethyl)-1-methyl-indol-5-yl]urea; fumaric acid Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)NC(=O)N)CCN.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)NC(=O)N)CCN.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C12H16N4O.C4H4O4/c1-16-7-8(4-5-13)10-6-9(15-12(14)17)2-3-11(10)16;5-3(6)1-2-4(7)8/h2-3,6-7H,4-5,13H2,1H3,(H3,14,15,17);1-2H,(H,5,6)(H,7,8)/b;2-1+