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ethyl 3-nitro-5-[(phenylmethyl)-propan-2-yl-carbamoyl]benzoate

ethyl 3-nitro-5-[(phenylmethyl)-propan-2-yl-carbamoyl]benzoate

Systemtic Name:ethyl 3-nitro-5-[(phenylmethyl)-propan-2-yl-carbamoyl]benzoate
Openeye Name:ethyl 3-[benzyl(isopropyl)carbamoyl]-5-nitro-benzoate
CAS Name:3-nitro-5-[oxo-[(phenylmethyl)-propan-2-ylamino]methyl]benzoic acid ethyl ester
IUPAC Name:ethyl 3-[benzyl(propan-2-yl)carbamoyl]-5-nitrobenzoate
Traditional Name:3-[benzyl(isopropyl)carbamoyl]-5-nitro-benzoic acid ethyl ester
Formula: C20H22N2O5
MolecularWeight: 370.39908
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CC=C2)C(C)C)[N+](=O)[O-]


Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CC=C2)C(C)C)[N+](=O)[O-]


InChI

InChI=1S/C20H22N2O5/c1-4-27-20(24)17-10-16(11-18(12-17)22(25)26)19(23)21(14(2)3)13-15-8-6-5-7-9-15/h5-12,14H,4,13H2,1-3H3


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