4-phenylazanyl-3-(pyrrolidin-1-ium-1-ylmethyl)chromen-2-one

Systemtic Name: 4-phenylazanyl-3-(pyrrolidin-1-ium-1-ylmethyl)chromen-2-one Openeye Name: 4-anilino-3-(pyrrolidin-1-ium-1-ylmethyl)chromen-2-one CAS Name: 4-anilino-3-(1-pyrrolidin-1-iumylmethyl)-1-benzopyran-2-one IUPAC Name: 4-anilino-3-(pyrrolidin-1-ium-1-ylmethyl)chromen-2-one Traditional Name: 4-anilino-3-(pyrrolidin-1-ium-1-ylmethyl)coumarin Formula: C20H21N2O2+ MolecularWeight: 321.39294

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=C(C3=CC=CC=C3OC2=O)NC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CC2=C(C3=CC=CC=C3OC2=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H20N2O2/c23-20-17(14-22-12-6-7-13-22)19(21-15-8-2-1-3-9-15)16-10-4-5-11-18(16)24-20/h1-5,8-11,21H,6-7,12-14H2/p+1