1-[(3-methoxyphenyl)methyl]-3-(2-oxidanyl-4-pyrrolidin-1-ium-1-ylidene-chromen-3-yl)urea

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-3-(2-oxidanyl-4-pyrrolidin-1-ium-1-ylidene-chromen-3-yl)urea Openeye Name: 1-(2-hydroxy-4-pyrrolidin-1-ium-1-ylidene-chromen-3-yl)-3-[(3-methoxyphenyl)methyl]urea CAS Name: 1-[2-hydroxy-4-(1-pyrrolidin-1-iumylidene)-1-benzopyran-3-yl]-3-[(3-methoxyphenyl)methyl]urea IUPAC Name: 1-(2-hydroxy-4-pyrrolidin-1-ium-1-ylidenechromen-3-yl)-3-[(3-methoxyphenyl)methyl]urea Traditional Name: 1-(2-hydroxy-4-pyrrolidin-1-ium-1-ylidene-chromen-3-yl)-3-m-anisyl-urea Formula: C22H24N3O4+ MolecularWeight: 394.44366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)NC2=C(OC3=CC=CC=C3C2=[N+]4CCCC4)O

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)NC2=C(OC3=CC=CC=C3C2=[N+]4CCCC4)O

InChI

InChI=1S/C22H23N3O4/c1-28-16-8-6-7-15(13-16)14-23-22(27)24-19-20(25-11-4-5-12-25)17-9-2-3-10-18(17)29-21(19)26/h2-3,6-10,13H,4-5,11-12,14H2,1H3,(H2,23,24,27)/p+1