4-(4-pyrrolidin-1-ium-1-ylpiperidin-1-yl)chromen-2-one

Systemtic Name: 4-(4-pyrrolidin-1-ium-1-ylpiperidin-1-yl)chromen-2-one Openeye Name: 4-(4-pyrrolidin-1-ium-1-yl-1-piperidyl)chromen-2-one CAS Name: 4-[4-(1-pyrrolidin-1-iumyl)-1-piperidinyl]-1-benzopyran-2-one IUPAC Name: 4-(4-pyrrolidin-1-ium-1-ylpiperidin-1-yl)chromen-2-one Traditional Name: 4-(4-pyrrolidin-1-ium-1-ylpiperidino)coumarin Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CCN(CC2)C3=CC(=O)OC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)C2CCN(CC2)C3=CC(=O)OC4=CC=CC=C43

InChI

InChI=1S/C18H22N2O2/c21-18-13-16(15-5-1-2-6-17(15)22-18)20-11-7-14(8-12-20)19-9-3-4-10-19/h1-2,5-6,13-14H,3-4,7-12H2/p+1