N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O4/c1-2-32-22-13-12-17(15-21(22)28(30)31)24(29)27-20(14-16-8-4-3-5-9-16)23-25-18-10-6-7-11-19(18)26-23/h3-13,15,20H,2,14H2,1H3,(H,25,26)(H,27,29)/t20-/m0/s1