N,N-dipropyl-7-pyrrolidin-1-ium-1-ylidene-phenoxazin-3-amine chloride

Systemtic Name: N,N-dipropyl-7-pyrrolidin-1-ium-1-ylidene-phenoxazin-3-amine chloride Openeye Name: N,N-dipropyl-7-pyrrolidin-1-ium-1-ylidene-phenoxazin-3-amine chloride CAS Name: N,N-dipropyl-7-(1-pyrrolidin-1-iumylidene)-3-phenoxazinamine chloride IUPAC Name: N,N-dipropyl-7-pyrrolidin-1-ium-1-ylidenephenoxazin-3-amine chloride Traditional Name: dipropyl-(7-pyrrolidin-1-ium-1-ylidenephenoxazin-3-yl)amine chloride Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC2=C(C=C1)N=C3C=CC(=[N+]4CCCC4)C=C3O2.[Cl-]

Isomeric SMILES

CCCN(CCC)C1=CC2=C(C=C1)N=C3C=CC(=[N+]4CCCC4)C=C3O2.[Cl-]

InChI

InChI=1S/C22H28N3O.ClH/c1-3-11-24(12-4-2)17-7-9-19-21(15-17)26-22-16-18(8-10-20(22)23-19)25-13-5-6-14-25;/h7-10,15-16H,3-6,11-14H2,1-2H3;1H/q+1;/p-1