N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[2-[(4-ethyl-1-piperazinyl)methyl]-1-propan-2-yl-5-benzimidazolyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[2-[(4-ethylpiperazino)methyl]-1-isopropyl-benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide Formula: C25H32N6O4 MolecularWeight: 480.55938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H32N6O4/c1-4-28-11-13-29(14-12-28)16-24-27-22-15-19(5-10-23(22)30(24)18(2)3)26-25(32)17-35-21-8-6-20(7-9-21)31(33)34/h5-10,15,18H,4,11-14,16-17H2,1-3H3,(H,26,32)