cyclohexyl-[3-[(3-nitrophenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]azanium

Systemtic Name: cyclohexyl-[3-[(3-nitrophenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]azanium Openeye Name: cyclohexyl-[2-hydroxy-3-[(3-nitrophenyl)carbamoylamino]chromen-4-ylidene]ammonium CAS Name: cyclohexyl-[2-hydroxy-3-[[(3-nitroanilino)-oxomethyl]amino]-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclohexyl-[2-hydroxy-3-[(3-nitrophenyl)carbamoylamino]chromen-4-ylidene]azanium Traditional Name: cyclohexyl-[2-hydroxy-3-[(3-nitrophenyl)carbamoylamino]chromen-4-ylidene]ammonium Formula: C22H23N4O5+ MolecularWeight: 423.44182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NC4=CC(=CC=C4)[N+](=O)[O-])O

Isomeric SMILES

C1CCC(CC1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NC4=CC(=CC=C4)[N+](=O)[O-])O

InChI

InChI=1S/C22H22N4O5/c27-21-20(25-22(28)24-15-9-6-10-16(13-15)26(29)30)19(23-14-7-2-1-3-8-14)17-11-4-5-12-18(17)31-21/h4-6,9-14,27H,1-3,7-8H2,(H2,24,25,28)/p+1