cyclopentyl-[3-[(4-methylphenyl)carbonylamino]-2-oxidanyl-chromen-4-ylidene]azanium

Systemtic Name: cyclopentyl-[3-[(4-methylphenyl)carbonylamino]-2-oxidanyl-chromen-4-ylidene]azanium Openeye Name: cyclopentyl-[2-hydroxy-3-[(4-methylbenzoyl)amino]chromen-4-ylidene]ammonium CAS Name: cyclopentyl-[2-hydroxy-3-[[(4-methylphenyl)-oxomethyl]amino]-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclopentyl-[2-hydroxy-3-[(4-methylbenzoyl)amino]chromen-4-ylidene]azanium Traditional Name: cyclopentyl-[2-hydroxy-3-(p-toluoylamino)chromen-4-ylidene]ammonium Formula: C22H23N2O3+ MolecularWeight: 363.42962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]C4CCCC4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]C4CCCC4)O

InChI

InChI=1S/C22H22N2O3/c1-14-10-12-15(13-11-14)21(25)24-20-19(23-16-6-2-3-7-16)17-8-4-5-9-18(17)27-22(20)26/h4-5,8-13,16,26H,2-3,6-7H2,1H3,(H,24,25)/p+1