N-cyclopropyl-2-ethyl-6-(furan-2-yl)-7-propyl-1,3-benzoxazol-3-ium-3-carboxamide

Systemtic Name: N-cyclopropyl-2-ethyl-6-(furan-2-yl)-7-propyl-1,3-benzoxazol-3-ium-3-carboxamide Openeye Name: N-cyclopropyl-2-ethyl-6-(2-furyl)-7-propyl-1,3-benzoxazol-3-ium-3-carboxamide CAS Name: N-cyclopropyl-2-ethyl-6-(2-furanyl)-7-propyl-1,3-benzoxazol-3-ium-3-carboxamide IUPAC Name: N-cyclopropyl-2-ethyl-6-(furan-2-yl)-7-propyl-1,3-benzoxazol-3-ium-3-carboxamide Traditional Name: N-cyclopropyl-2-ethyl-6-(2-furyl)-7-propyl-1,3-benzoxazol-3-ium-3-carboxamide Formula: C20H23N2O3+ MolecularWeight: 339.40822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(=[N+]2C(=O)NC3CC3)CC)C4=CC=CO4

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(=[N+]2C(=O)NC3CC3)CC)C4=CC=CO4

InChI

InChI=1S/C20H22N2O3/c1-3-6-15-14(17-7-5-12-24-17)10-11-16-19(15)25-18(4-2)22(16)20(23)21-13-8-9-13/h5,7,10-13H,3-4,6,8-9H2,1-2H3/p+1