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

Systemtic Name: cyclopentyl-[2-oxidanyl-3-(phenethylcarbamoylamino)chromen-4-ylidene]azanium Openeye Name: cyclopentyl-[2-hydroxy-3-(phenethylcarbamoylamino)chromen-4-ylidene]ammonium CAS Name: cyclopentyl-[2-hydroxy-3-[[oxo-(phenethylamino)methyl]amino]-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclopentyl-[2-hydroxy-3-(phenethylcarbamoylamino)chromen-4-ylidene]azanium Traditional Name: cyclopentyl-[2-hydroxy-3-(phenethylcarbamoylamino)chromen-4-ylidene]ammonium Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NCCC4=CC=CC=C4)O

Isomeric SMILES

C1CCC(C1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NCCC4=CC=CC=C4)O

InChI

InChI=1S/C23H25N3O3/c27-22-21(26-23(28)24-15-14-16-8-2-1-3-9-16)20(25-17-10-4-5-11-17)18-12-6-7-13-19(18)29-22/h1-3,6-9,12-13,17,27H,4-5,10-11,14-15H2,(H2,24,26,28)/p+1