(3-aminocarbonyl-6-hexyl-7-oxidanyl-chromen-2-ylidene)-(4-phenoxyphenyl)azanium

Systemtic Name: (3-aminocarbonyl-6-hexyl-7-oxidanyl-chromen-2-ylidene)-(4-phenoxyphenyl)azanium Openeye Name: (3-carbamoyl-6-hexyl-7-hydroxy-chromen-2-ylidene)-(4-phenoxyphenyl)ammonium CAS Name: (3-carbamoyl-6-hexyl-7-hydroxy-1-benzopyran-2-ylidene)-(4-phenoxyphenyl)ammonium IUPAC Name: (3-carbamoyl-6-hexyl-7-hydroxychromen-2-ylidene)-(4-phenoxyphenyl)azanium Traditional Name: (3-carbamoyl-6-hexyl-7-hydroxy-chromen-2-ylidene)-(4-phenoxyphenyl)ammonium Formula: C28H29N2O4+ MolecularWeight: 457.54086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=[NH+]C3=CC=C(C=C3)OC4=CC=CC=C4)O2)C(=O)N)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=[NH+]C3=CC=C(C=C3)OC4=CC=CC=C4)O2)C(=O)N)O

InChI

InChI=1S/C28H28N2O4/c1-2-3-4-6-9-19-16-20-17-24(27(29)32)28(34-26(20)18-25(19)31)30-21-12-14-23(15-13-21)33-22-10-7-5-8-11-22/h5,7-8,10-18,31H,2-4,6,9H2,1H3,(H2,29,32)/p+1