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

Systemtic Name: ethyl 3-[cyclopropyl(thiophen-2-ylmethyl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[cyclopropyl(2-thienylmethyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[cyclopropyl(thiophen-2-ylmethyl)amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[cyclopropyl(thiophen-2-ylmethyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[cyclopropyl(2-thenyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CS2)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CS2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5S/c1-2-25-18(22)13-8-12(9-15(10-13)20(23)24)17(21)19(14-5-6-14)11-16-4-3-7-26-16/h3-4,7-10,14H,2,5-6,11H2,1H3