(2S)-N-(3-imidazol-1-ylpropyl)-1,2-dihydrobenzo[e][1]benzofuran-2-carboxamide

Systemtic Name: (2S)-N-(3-imidazol-1-ylpropyl)-1,2-dihydrobenzo[e][1]benzofuran-2-carboxamide Openeye Name: (2S)-N-(3-imidazol-1-ylpropyl)-1,2-dihydrobenzo[e]benzofuran-2-carboxamide CAS Name: (2S)-N-[3-(1-imidazolyl)propyl]-1,2-dihydrobenzo[e]benzofuran-2-carboxamide IUPAC Name: (2S)-N-(3-imidazol-1-ylpropyl)-1,2-dihydrobenzo[e][1]benzofuran-2-carboxamide Traditional Name: (2S)-N-(3-imidazol-1-ylpropyl)-1,2-dihydrobenzo[e]benzofuran-2-carboxamide Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C3=CC=CC=C3C=C2)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

C1[C@H](OC2=C1C3=CC=CC=C3C=C2)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C19H19N3O2/c23-19(21-8-3-10-22-11-9-20-13-22)18-12-16-15-5-2-1-4-14(15)6-7-17(16)24-18/h1-2,4-7,9,11,13,18H,3,8,10,12H2,(H,21,23)/t18-/m0/s1