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

Systemtic Name: cyclopentyl-[2-oxidanyl-3-[(phenylmethyl)carbamoylamino]chromen-4-ylidene]azanium Openeye Name: [3-(benzylcarbamoylamino)-2-hydroxy-chromen-4-ylidene]-cyclopentyl-ammonium CAS Name: cyclopentyl-[2-hydroxy-3-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-benzopyran-4-ylidene]ammonium IUPAC Name: [3-(benzylcarbamoylamino)-2-hydroxychromen-4-ylidene]-cyclopentylazanium Traditional Name: [3-(benzylcarbamoylamino)-2-hydroxy-chromen-4-ylidene]-cyclopentyl-ammonium Formula: C22H24N3O3+ MolecularWeight: 378.44426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NCC4=CC=CC=C4)O

Isomeric SMILES

C1CCC(C1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)NCC4=CC=CC=C4)O

InChI

InChI=1S/C22H23N3O3/c26-21-20(25-22(27)23-14-15-8-2-1-3-9-15)19(24-16-10-4-5-11-16)17-12-6-7-13-18(17)28-21/h1-3,6-9,12-13,16,26H,4-5,10-11,14H2,(H2,23,25,27)/p+1