2-[2-(1-benzofuran-2-ylmethylamino)-1H-indol-3-yl]-N-nitro-4-phenyl-butanamide

Systemtic Name: 2-[2-(1-benzofuran-2-ylmethylamino)-1H-indol-3-yl]-N-nitro-4-phenyl-butanamide Openeye Name: 2-[2-(benzofuran-2-ylmethylamino)-1H-indol-3-yl]-N-nitro-4-phenyl-butanamide CAS Name: 2-[2-(2-benzofuranylmethylamino)-1H-indol-3-yl]-N-nitro-4-phenylbutanamide IUPAC Name: 2-[2-(1-benzofuran-2-ylmethylamino)-1H-indol-3-yl]-N-nitro-4-phenylbutanamide Traditional Name: 2-[2-(benzofuran-2-ylmethylamino)-1H-indol-3-yl]-N-nitro-4-phenyl-butyramide Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C2=C(NC3=CC=CC=C32)NCC4=CC5=CC=CC=C5O4)C(=O)N[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC(C2=C(NC3=CC=CC=C32)NCC4=CC5=CC=CC=C5O4)C(=O)N[N+](=O)[O-]

InChI

InChI=1S/C27H24N4O4/c32-27(30-31(33)34)22(15-14-18-8-2-1-3-9-18)25-21-11-5-6-12-23(21)29-26(25)28-17-20-16-19-10-4-7-13-24(19)35-20/h1-13,16,22,28-29H,14-15,17H2,(H,30,32)