[2-oxidanyl-3-(thiophen-2-ylcarbonylamino)chromen-4-ylidene]-(phenylmethyl)azanium

Systemtic Name: [2-oxidanyl-3-(thiophen-2-ylcarbonylamino)chromen-4-ylidene]-(phenylmethyl)azanium Openeye Name: benzyl-[2-hydroxy-3-(thiophene-2-carbonylamino)chromen-4-ylidene]ammonium CAS Name: [2-hydroxy-3-[[oxo(thiophen-2-yl)methyl]amino]-1-benzopyran-4-ylidene]-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-hydroxy-3-(thiophene-2-carbonylamino)chromen-4-ylidene]azanium Traditional Name: benzyl-[2-hydroxy-3-(2-thenoylamino)chromen-4-ylidene]ammonium Formula: C21H17N2O3S+ MolecularWeight: 377.43628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)C4=CC=CS4)O

Isomeric SMILES

C1=CC=C(C=C1)C[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)C4=CC=CS4)O

InChI

InChI=1S/C21H16N2O3S/c24-20(17-11-6-12-27-17)23-19-18(22-13-14-7-2-1-3-8-14)15-9-4-5-10-16(15)26-21(19)25/h1-12,25H,13H2,(H,23,24)/p+1