3-oxidanyl-4-(pyrrolidin-1-ium-1-ylmethyl)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one

Systemtic Name: 3-oxidanyl-4-(pyrrolidin-1-ium-1-ylmethyl)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 3-hydroxy-4-(pyrrolidin-1-ium-1-ylmethyl)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 3-hydroxy-4-(1-pyrrolidin-1-iumylmethyl)-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 3-hydroxy-4-(pyrrolidin-1-ium-1-ylmethyl)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 3-hydroxy-4-(pyrrolidin-1-ium-1-ylmethyl)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Formula: C18H22NO3+ MolecularWeight: 300.37218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(C(=C(C=C3)O)C[NH+]4CCCC4)OC2=O

Isomeric SMILES

C1CCC2=C(C1)C3=C(C(=C(C=C3)O)C[NH+]4CCCC4)OC2=O

InChI

InChI=1S/C18H21NO3/c20-16-8-7-13-12-5-1-2-6-14(12)18(21)22-17(13)15(16)11-19-9-3-4-10-19/h7-8,20H,1-6,9-11H2/p+1