naphthalen-1-ylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: 1-naphthylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid 1-naphthylmethyl ester Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CC=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CC=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4/c1-18-10-14(19(21)22)9-16(18)17(20)23-11-13-7-4-6-12-5-2-3-8-15(12)13/h2-10H,11H2,1H3