7-[3-(ethylamino)propyl]-2-propan-2-yl-1,3-benzoxazol-3-ium-3-carboxamide

Systemtic Name: 7-[3-(ethylamino)propyl]-2-propan-2-yl-1,3-benzoxazol-3-ium-3-carboxamide Openeye Name: 7-[3-(ethylamino)propyl]-2-isopropyl-1,3-benzoxazol-3-ium-3-carboxamide CAS Name: 7-[3-(ethylamino)propyl]-2-propan-2-yl-1,3-benzoxazol-3-ium-3-carboxamide IUPAC Name: 7-[3-(ethylamino)propyl]-2-propan-2-yl-1,3-benzoxazol-3-ium-3-carboxamide Traditional Name: 7-[3-(ethylamino)propyl]-2-isopropyl-1,3-benzoxazol-3-ium-3-carboxamide Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCNCCCC1=C2C(=CC=C1)[N+](=C(O2)C(C)C)C(=O)N

Isomeric SMILES

CCNCCCC1=C2C(=CC=C1)[N+](=C(O2)C(C)C)C(=O)N

InChI

InChI=1S/C16H23N3O2/c1-4-18-10-6-8-12-7-5-9-13-14(12)21-15(11(2)3)19(13)16(17)20/h5,7,9,11,18H,4,6,8,10H2,1-3H3,(H-,17,20)/p+1