N-(1H-benzimidazol-2-ylmethyl)-2-(cyclopentylamino)-5-nitro-benzamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-(cyclopentylamino)-5-nitro-benzamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(cyclopentylamino)-5-nitro-benzamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-(cyclopentylamino)-5-nitrobenzamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(cyclopentylamino)-5-nitrobenzamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-(cyclopentylamino)-5-nitro-benzamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CCC(C1)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H21N5O3/c26-20(21-12-19-23-17-7-3-4-8-18(17)24-19)15-11-14(25(27)28)9-10-16(15)22-13-5-1-2-6-13/h3-4,7-11,13,22H,1-2,5-6,12H2,(H,21,26)(H,23,24)