3-(2-azanylethyl)-N'-phenyl-1H-indole-5-carboximidamide; (E)-but-2-enedioic acid

Systemtic Name: 3-(2-azanylethyl)-N'-phenyl-1H-indole-5-carboximidamide; (E)-but-2-enedioic acid Openeye Name: 3-(2-aminoethyl)-N'-phenyl-1H-indole-5-carboxamidine; fumaric acid CAS Name: 3-(2-aminoethyl)-N'-phenyl-1H-indole-5-carboximidamide; (E)-2-butenedioic acid IUPAC Name: 3-(2-aminoethyl)-N'-phenyl-1H-indole-5-carboximidamide; (E)-but-2-enedioic acid Traditional Name: 3-(2-aminoethyl)-N'-phenyl-1H-indole-5-carboxamidine; fumaric acid Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(C2=CC3=C(C=C2)NC=C3CCN)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=C(C2=CC3=C(C=C2)NC=C3CCN)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C17H18N4.C4H4O4/c18-9-8-13-11-20-16-7-6-12(10-15(13)16)17(19)21-14-4-2-1-3-5-14;5-3(6)1-2-4(7)8/h1-7,10-11,20H,8-9,18H2,(H2,19,21);1-2H,(H,5,6)(H,7,8)/b;2-1+