3-[2-(1-benzofuran-2-ylmethylamino)-3-(1-nitroindol-3-yl)phenyl]-2-methyl-propanamide

Systemtic Name: 3-[2-(1-benzofuran-2-ylmethylamino)-3-(1-nitroindol-3-yl)phenyl]-2-methyl-propanamide Openeye Name: 3-[2-(benzofuran-2-ylmethylamino)-3-(1-nitroindol-3-yl)phenyl]-2-methyl-propanamide CAS Name: 3-[2-(2-benzofuranylmethylamino)-3-(1-nitro-3-indolyl)phenyl]-2-methylpropanamide IUPAC Name: 3-[2-(1-benzofuran-2-ylmethylamino)-3-(1-nitroindol-3-yl)phenyl]-2-methylpropanamide Traditional Name: 3-[2-(benzofuran-2-ylmethylamino)-3-(1-nitroindol-3-yl)phenyl]-2-methyl-propionamide Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC(=C1NCC2=CC3=CC=CC=C3O2)C4=CN(C5=CC=CC=C54)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CC(CC1=CC=CC(=C1NCC2=CC3=CC=CC=C3O2)C4=CN(C5=CC=CC=C54)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C27H24N4O4/c1-17(27(28)32)13-19-8-6-10-22(23-16-30(31(33)34)24-11-4-3-9-21(23)24)26(19)29-15-20-14-18-7-2-5-12-25(18)35-20/h2-12,14,16-17,29H,13,15H2,1H3,(H2,28,32)