[(2S)-2-(1H-indol-3-yl)-2-phenyl-ethyl]-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: [(2S)-2-(1H-indol-3-yl)-2-phenyl-ethyl]-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl-[(2S)-2-(1H-indol-3-yl)-2-phenyl-ethyl]ammonium CAS Name: (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(2S)-2-(1H-indol-3-yl)-2-phenylethyl]ammonium IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl-[(2S)-2-(1H-indol-3-yl)-2-phenylethyl]azanium Traditional Name: (7-hydroxy-2-keto-chromen-4-yl)methyl-[(2S)-2-(1H-indol-3-yl)-2-phenyl-ethyl]ammonium Formula: C26H23N2O3+ MolecularWeight: 411.47242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H22N2O3/c29-19-10-11-20-18(12-26(30)31-25(20)13-19)14-27-15-22(17-6-2-1-3-7-17)23-16-28-24-9-5-4-8-21(23)24/h1-13,16,22,27-29H,14-15H2/p+1/t22-/m0/s1