5-bromanyl-7-methoxy-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indole; (E)-but-2-enedioic acid

Systemtic Name: 5-bromanyl-7-methoxy-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indole; (E)-but-2-enedioic acid Openeye Name: 5-bromo-7-methoxy-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indole; fumaric acid CAS Name: 5-bromo-7-methoxy-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indole; (E)-2-butenedioic acid IUPAC Name: 5-bromo-7-methoxy-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indole; (E)-but-2-enedioic acid Traditional Name: 5-bromo-7-methoxy-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrol[2,3-b]indole; fumaric acid Formula: C18H23BrN2O5 MolecularWeight: 427.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCN(C1N(C3=C(C=C(C=C23)OC)Br)C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC12CCN(C1N(C3=C(C=C(C=C23)OC)Br)C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H19BrN2O.C4H4O4/c1-14-5-6-16(2)13(14)17(3)12-10(14)7-9(18-4)8-11(12)15;5-3(6)1-2-4(7)8/h7-8,13H,5-6H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+