7-dodecyl-3-methoxy-5,6-dihydrobenzo[c]xanthen-12-ium

Systemtic Name: 7-dodecyl-3-methoxy-5,6-dihydrobenzo[c]xanthen-12-ium Openeye Name: 7-dodecyl-3-methoxy-5,6-dihydrobenzo[c]xanthen-12-ium CAS Name: 7-dodecyl-3-methoxy-5,6-dihydrobenzo[c]xanthen-12-ium IUPAC Name: 7-dodecyl-3-methoxy-5,6-dihydrobenzo[c]xanthen-12-ium Traditional Name: 7-lauryl-3-methoxy-5,6-dihydrobenzo[c]xanthen-12-ium Formula: C30H39O2+ MolecularWeight: 431.62946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C2CCC3=C(C2=[O+]C4=CC=CC=C41)C=CC(=C3)OC

Isomeric SMILES

CCCCCCCCCCCCC1=C2CCC3=C(C2=[O+]C4=CC=CC=C41)C=CC(=C3)OC

InChI

InChI=1S/C30H39O2/c1-3-4-5-6-7-8-9-10-11-12-15-26-27-16-13-14-17-29(27)32-30-25-21-19-24(31-2)22-23(25)18-20-28(26)30/h13-14,16-17,19,21-22H,3-12,15,18,20H2,1-2H3/q+1