1-(9-butoxyphenalen-1-ylidene)pyrrolidin-1-ium

Systemtic Name: 1-(9-butoxyphenalen-1-ylidene)pyrrolidin-1-ium Openeye Name: 1-(9-butoxyphenalen-1-ylidene)pyrrolidin-1-ium CAS Name: 1-(9-butoxy-1-phenalenylidene)pyrrolidin-1-ium IUPAC Name: 1-(9-butoxyphenalen-1-ylidene)pyrrolidin-1-ium Traditional Name: 1-(9-butoxyphenalen-1-ylidene)pyrrolidin-1-ium Formula: C21H24NO+ MolecularWeight: 306.42136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C2C(=[N+]3CCCC3)C=CC4=CC=CC(=C42)C=C1

Isomeric SMILES

CCCCOC1=C2C(=[N+]3CCCC3)C=CC4=CC=CC(=C42)C=C1

InChI

InChI=1S/C21H24NO/c1-2-3-15-23-19-12-10-17-8-6-7-16-9-11-18(21(19)20(16)17)22-13-4-5-14-22/h6-12H,2-5,13-15H2,1H3/q+1