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

Systemtic Name: (E)-but-2-enedioic acid; 2-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)ethanamine Openeye Name: fumaric acid; 2-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)ethanamine CAS Name: (E)-2-butenedioic acid; 2-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)ethanamine IUPAC Name: (E)-but-2-enedioic acid; 2-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)ethanamine Traditional Name: fumaric acid; 2-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)ethylamine Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC3=C2N(C=C3)CCN)C=C1.C(=CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC2=C(CC3=C2N(C=C3)CCN)C=C1.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H16N2O.C4H4O4/c1-17-12-3-2-10-8-11-4-6-16(7-5-15)14(11)13(10)9-12;5-3(6)1-2-4(7)8/h2-4,6,9H,5,7-8,15H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+