methyl 3-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbonyl-5-nitro-benzoate

Systemtic Name: methyl 3-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbonyl-5-nitro-benzoate Openeye Name: methyl 3-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbonyl]-5-nitro-benzoate CAS Name: 3-[[4-[1-[(3,5-dimethoxyphenyl)methyl]-2-imidazolyl]-1-piperidinyl]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbonyl]-5-nitrobenzoate Traditional Name: 3-[4-[1-(3,5-dimethoxybenzyl)imidazol-2-yl]piperidine-1-carbonyl]-5-nitro-benzoic acid methyl ester Formula: C26H28N4O7 MolecularWeight: 508.52312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2C=CN=C2C3CCN(CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2C=CN=C2C3CCN(CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])C(=O)OC)OC

InChI

InChI=1S/C26H28N4O7/c1-35-22-10-17(11-23(15-22)36-2)16-29-9-6-27-24(29)18-4-7-28(8-5-18)25(31)19-12-20(26(32)37-3)14-21(13-19)30(33)34/h6,9-15,18H,4-5,7-8,16H2,1-3H3