methyl 2-(2-nitro-1-phenyl-propyl)-1-(2-phenylpropylidene)pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl 2-(2-nitro-1-phenyl-propyl)-1-(2-phenylpropylidene)pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl 2-(2-nitro-1-phenyl-propyl)-1-(2-phenylpropylidene)pyrrolidin-1-ium-2-carboxylate CAS Name: 2-(2-nitro-1-phenylpropyl)-1-(2-phenylpropylidene)-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 2-(2-nitro-1-phenylpropyl)-1-(2-phenylpropylidene)pyrrolidin-1-ium-2-carboxylate Traditional Name: 2-(2-nitro-1-phenyl-propyl)-1-(2-phenylpropylidene)pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=[N+]1CCCC1(C(C2=CC=CC=C2)[C-](C)[N+](=O)[O-])C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C=[N+]1CCCC1(C(C2=CC=CC=C2)[C-](C)[N+](=O)[O-])C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4/c1-18(20-11-6-4-7-12-20)17-25-16-10-15-24(25,23(27)30-3)22(19(2)26(28)29)21-13-8-5-9-14-21/h4-9,11-14,17-18,22H,10,15-16H2,1-3H3