(E)-but-2-enedioic acid; N-methyl-2-phenyl-1,3-dihydroinden-2-amine

Systemtic Name: (E)-but-2-enedioic acid; N-methyl-2-phenyl-1,3-dihydroinden-2-amine Openeye Name: fumaric acid; N-methyl-2-phenyl-indan-2-amine CAS Name: (E)-2-butenedioic acid; N-methyl-2-phenyl-1,3-dihydroinden-2-amine IUPAC Name: (E)-but-2-enedioic acid; N-methyl-2-phenyl-1,3-dihydroinden-2-amine Traditional Name: fumaric acid; methyl-(2-phenylindan-2-yl)amine Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CNC1(CC2=CC=CC=C2C1)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CNC1(CC2=CC=CC=C2C1)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H17N.C4H4O4/c1-17-16(15-9-3-2-4-10-15)11-13-7-5-6-8-14(13)12-16;5-3(6)1-2-4(7)8/h2-10,17H,11-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+