(3-oxidanyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-4-yl)methyl-bis(phenylmethyl)azanium

Systemtic Name: (3-oxidanyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-4-yl)methyl-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(3-hydroxy-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-4-yl)methyl]ammonium CAS Name: (3-hydroxy-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-4-yl)methyl-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(3-hydroxy-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-4-yl)methyl]azanium Traditional Name: dibenzyl-[(3-hydroxy-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-4-yl)methyl]ammonium Formula: C28H28NO3+ MolecularWeight: 426.52682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(C(=C(C=C3)O)C[NH+](CC4=CC=CC=C4)CC5=CC=CC=C5)OC2=O

Isomeric SMILES

C1CCC2=C(C1)C3=C(C(=C(C=C3)O)C[NH+](CC4=CC=CC=C4)CC5=CC=CC=C5)OC2=O

InChI

InChI=1S/C28H27NO3/c30-26-16-15-23-22-13-7-8-14-24(22)28(31)32-27(23)25(26)19-29(17-20-9-3-1-4-10-20)18-21-11-5-2-6-12-21/h1-6,9-12,15-16,30H,7-8,13-14,17-19H2/p+1