ethyl 3-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(R)-(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C22H22N4O6 MolecularWeight: 438.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C2=CC=C(C=C2)OC)C3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N[C@H](C2=CC=C(C=C2)OC)C3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O6/c1-4-32-22(28)16-11-15(12-17(13-16)26(29)30)21(27)24-19(20-23-9-10-25(20)2)14-5-7-18(31-3)8-6-14/h5-13,19H,4H2,1-3H3,(H,24,27)/t19-/m1/s1