1-(6-pyrrolidin-1-ium-1-ylidenexanthen-3-yl)pyrrolidine nitrate

Systemtic Name: 1-(6-pyrrolidin-1-ium-1-ylidenexanthen-3-yl)pyrrolidine nitrate Openeye Name: 1-(6-pyrrolidin-1-ium-1-ylidenexanthen-3-yl)pyrrolidine nitrate CAS Name: 1-[6-(1-pyrrolidin-1-iumylidene)-3-xanthenyl]pyrrolidine nitrate IUPAC Name: 1-(6-pyrrolidin-1-ium-1-ylidenexanthen-3-yl)pyrrolidine nitrate Traditional Name: 1-(6-pyrrolidin-1-ium-1-ylidenexanthen-3-yl)pyrrolidine nitrate Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=C(C=C2)C=C4C=CC(=[N+]5CCCC5)C=C4O3.[N+](=O)([O-])[O-]

Isomeric SMILES

C1CCN(C1)C2=CC3=C(C=C2)C=C4C=CC(=[N+]5CCCC5)C=C4O3.[N+](=O)([O-])[O-]

InChI

InChI=1S/C21H23N2O.NO3/c1-2-10-22(9-1)18-7-5-16-13-17-6-8-19(23-11-3-4-12-23)15-21(17)24-20(16)14-18;2-1(3)4/h5-8,13-15H,1-4,9-12H2;/q+1;-1