[4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(2-furylmethyl)-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: [4-[(cyclopropylamino)-oxomethyl]phenyl]methyl-(2-furanylmethyl)-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl]azanium Traditional Name: [4-(cyclopropylcarbamoyl)benzyl]-(2-furfuryl)-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl]ammonium Formula: C27H27N2O5+ MolecularWeight: 459.51368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C[NH+](CC3=CC=C(C=C3)C(=O)NC4CC4)CC5=CC=CO5)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C[NH+](CC3=CC=C(C=C3)C(=O)NC4CC4)CC5=CC=CO5)O

InChI

InChI=1S/C27H26N2O5/c1-17-24(30)11-10-23-20(13-25(31)34-26(17)23)15-29(16-22-3-2-12-33-22)14-18-4-6-19(7-5-18)27(32)28-21-8-9-21/h2-7,10-13,21,30H,8-9,14-16H2,1H3,(H,28,32)/p+1