4-(dimethylamino)butyl ethanoate; ethanoic acid; triphenylphosphanium

Systemtic Name: 4-(dimethylamino)butyl ethanoate; ethanoic acid; triphenylphosphanium Openeye Name: acetic acid; 4-(dimethylamino)butyl acetate; triphenylphosphonium CAS Name: acetic acid; acetic acid 4-(dimethylamino)butyl ester; triphenylphosphonium IUPAC Name: acetic acid; 4-(dimethylamino)butyl acetate; triphenylphosphanium Traditional Name: acetic acid; acetic acid 4-(dimethylamino)butyl ester; triphenylphosphonium Formula: C28H37NO4P+ MolecularWeight: 482.571441

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)OCCCCN(C)C.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)O.CC(=O)OCCCCN(C)C.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15P.C8H17NO2.C2H4O2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-8(10)11-7-5-4-6-9(2)3;1-2(3)4/h1-15H;4-7H2,1-3H3;1H3,(H,3,4)/p+1