(E)-but-2-enedioic acid; 1-(7-propan-2-yl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-(7-propan-2-yl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine Openeye Name: fumaric acid; 1-(7-isopropyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine CAS Name: (E)-2-butenedioic acid; 1-(7-propan-2-yl-4H-indeno[1,2-b]pyrrol-1-yl)-2-propanamine IUPAC Name: (E)-but-2-enedioic acid; 1-(7-propan-2-yl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine Traditional Name: fumaric acid; [2-(7-isopropyl-4H-indeno[1,2-b]pyrrol-1-yl)-1-methyl-ethyl]amine Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(CC3=C2N(C=C3)CC(C)N)C=C1.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=CC2=C(CC3=C2N(C=C3)CC(C)N)C=C1.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C17H22N2.C4H4O4/c1-11(2)13-4-5-14-8-15-6-7-19(10-12(3)18)17(15)16(14)9-13;5-3(6)1-2-4(7)8/h4-7,9,11-12H,8,10,18H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+