ethyl 3-[ethyl(thiophen-2-ylmethyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[ethyl(thiophen-2-ylmethyl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[ethyl(2-thienylmethyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[ethyl(thiophen-2-ylmethyl)amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[ethyl(thiophen-2-ylmethyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[ethyl(2-thenyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCN(CC1=CC=CS1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C17H18N2O5S/c1-3-18(11-15-6-5-7-25-15)16(20)12-8-13(17(21)24-4-2)10-14(9-12)19(22)23/h5-10H,3-4,11H2,1-2H3