methyl 3-[cyclopropyl-[(5-methylfuran-2-yl)methyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[cyclopropyl-[(5-methylfuran-2-yl)methyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[cyclopropyl-[(5-methyl-2-furyl)methyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[cyclopropyl-[(5-methyl-2-furanyl)methyl]amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[cyclopropyl-[(5-methylfuran-2-yl)methyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[cyclopropyl-[(5-methyl-2-furyl)methyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C2CC2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC=C(O1)CN(C2CC2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H18N2O6/c1-11-3-6-16(26-11)10-19(14-4-5-14)17(21)12-7-13(18(22)25-2)9-15(8-12)20(23)24/h3,6-9,14H,4-5,10H2,1-2H3